Detailed information for compound 418885

Basic information

Technical information
  • TDR Targets ID: 418885
  • Name: 4-(imidazol-1-ylmethyl)-3-phenylchromen-2-one
  • MW: 302.327 | Formula: C19H14N2O2
  • H donors: 0 H acceptors: 2 LogP: 2.78 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=c1oc2ccccc2c(c1c1ccccc1)Cn1ccnc1
  • InChi: 1S/C19H14N2O2/c22-19-18(14-6-2-1-3-7-14)16(12-21-11-10-20-13-21)15-8-4-5-9-17(15)23-19/h1-11,13H,12H2
  • InChiKey: LEYZDEAPEBHISK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-(imidazol-1-ylmethyl)-3-phenyl-chromen-2-one
  • 4-(1-imidazolylmethyl)-3-phenyl-1-benzopyran-2-one
  • 4-(imidazol-1-ylmethyl)-3-phenyl-coumarin
  • 4-(1-imidazolylmethyl)-3-phenyl-2-chromenone

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens cytochrome P450, family 19, subfamily A, polypeptide 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Trypanosoma cruzi cytochrome P450, putative cytochrome P450, family 19, subfamily A, polypeptide 1 503 aa 425 aa 18.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni cathepsin F (C01 family) 0.0077 0.0062 0.0062
Brugia malayi calpain family protein 1 0.0728 0.3779 0.3779
Echinococcus multilocularis expressed protein 0.0438 0.2122 0.2122
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0077 0.0062 0.0201
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Loa Loa (eye worm) hypothetical protein 0.0646 0.3308 0.3295
Loa Loa (eye worm) hypothetical protein 0.0381 0.18 0.1784
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0381 0.18 0.18
Trypanosoma brucei cytoskeleton-associated protein CAP5.5, putative 0.0083 0.0095 0.0311
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0095
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.1818 1 1
Brugia malayi orphan nuclear receptor NR2E1 0.018 0.065 0.065
Echinococcus granulosus geminin 0.0169 0.0586 0.0586
Loa Loa (eye worm) nuclear receptor NHR-67 0.018 0.065 0.0632
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.018 0.065 0.065
Schistosoma mansoni hypothetical protein 0.0083 0.0095 0.0095
Trichomonas vaginalis conserved hypothetical protein 0.0083 0.0095 0.0311
Schistosoma mansoni nuclear receptor 0.018 0.065 0.065
Brugia malayi calpain 5 0.0192 0.072 0.072
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0381 0.18 0.18
Trypanosoma brucei centrin-3 0.0095 0.0166 0.054
Echinococcus granulosus cathepsin l cysteine peptidase 0.0077 0.0062 0.0062
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0083 0.0095 0.0095
Loa Loa (eye worm) hypothetical protein 0.0077 0.0062 0.0042
Echinococcus multilocularis programmed cell death protein 0.0095 0.0166 0.0166
Echinococcus granulosus cathepsin b 0.1818 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0077 0.0062 0.0201
Entamoeba histolytica protein kinase, putative 0.0192 0.072 1
Brugia malayi steroid hormone receptor 0.0381 0.18 0.18
Onchocerca volvulus 0.0077 0.0062 0.0192
Brugia malayi cathepsin L-like precursor 0.0069 0.002 0.002
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Onchocerca volvulus Cathepsin L homolog 0.0077 0.0062 0.0192
Schistosoma mansoni calpain-7 (C02 family) 0.0275 0.1191 0.1191
Brugia malayi nuclear receptor NHR-88 0.018 0.065 0.065
Trypanosoma cruzi centrin-3 0.0095 0.0166 0.0166
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0275 0.1191 0.1191
Toxoplasma gondii calpain family cysteine protease domain-containing protein 0.0083 0.0095 0.0112
Trichomonas vaginalis Clan CA, family C2, calpain-like cysteine peptidase 0.0083 0.0095 0.0311
Onchocerca volvulus 0.0077 0.0062 0.0192
Schistosoma mansoni hypothetical protein 0.0169 0.0586 0.0586
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0381 0.18 0.1784
Trypanosoma cruzi cytoskeleton-associated protein CAP5.5, putative 0.0083 0.0095 0.0095
Trichomonas vaginalis Clan CA, family C2, calpain-like cysteine peptidase 0.0083 0.0095 0.0311
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0381 0.18 0.18
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0201 0.0773 0.0755
Schistosoma mansoni cathepsin F (C01 family) 0.0077 0.0062 0.0062
Onchocerca volvulus 0.0077 0.0062 0.0192
Schistosoma mansoni coup transcription factor 0.0381 0.18 0.18
Schistosoma mansoni calpain-2 (C02 family) 0.0083 0.0095 0.0095
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0381 0.18 0.18
Schistosoma mansoni nuclear hormone receptor 0.0381 0.18 0.18
Onchocerca volvulus 0.0381 0.18 0.8121
Loa Loa (eye worm) steroid hormone receptor 0.0381 0.18 0.1784
Trypanosoma brucei Calpain-like protein CALP1.3 0.0083 0.0095 0.0311
Loa Loa (eye worm) hypothetical protein 0.0083 0.0095 0.0076
Trypanosoma brucei antigen, putative 0.0275 0.1191 0.3888
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0275 0.1191 0.3763
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0077 0.0062 0.6469
Loa Loa (eye worm) hypothetical protein 0.0381 0.18 0.1784
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0381 0.18 0.18
Trypanosoma cruzi cruzipain precursor, putative 0.0077 0.0062 0.0062
Echinococcus multilocularis ecdysone induced protein 78C 0.0381 0.18 0.18
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Brugia malayi nuclear receptor RXR 0.0201 0.0773 0.0773
Loa Loa (eye worm) hypothetical protein 0.0381 0.18 0.1784
Giardia lamblia Cathepsin B precursor 0.0603 0.3064 0.5
Brugia malayi Nuclear hormone receptor-like 1 0.0201 0.0773 0.0773
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0077 0.0062 0.0201
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0381 0.18 0.18
Trypanosoma cruzi conserved protein 0.0083 0.0095 0.0095
Onchocerca volvulus 0.018 0.065 0.2878
Plasmodium vivax calpain, putative 0.0275 0.1191 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0381 0.18 0.18
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0381 0.18 0.18
Onchocerca volvulus Protein ultraspiracle homolog 0.0381 0.18 0.8121
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0083 0.0095 0.0095
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.0062 0.0201
Trypanosoma brucei caltractin, putative 0.0095 0.0166 0.054
Loa Loa (eye worm) hypothetical protein 0.0381 0.18 0.1784
Echinococcus multilocularis cathepsin L cysteine protease 0.0077 0.0062 0.0062
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0275 0.1191 0.1191
Schistosoma mansoni steroid hormone receptor ad4bp 0.0381 0.18 0.18
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0381 0.18 0.18
Trypanosoma brucei kinesin, putative 0.0192 0.072 0.235
Echinococcus multilocularis geminin 0.0169 0.0586 0.0586
Toxoplasma gondii hypothetical protein 0.0083 0.0095 0.0112
Brugia malayi nuclear hormone receptor 0.018 0.065 0.065
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0077 0.0062 0.0201
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0275 0.1191 0.1191
Onchocerca volvulus Cathepsin F homolog 0.0077 0.0062 0.0192
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0771 0.4025 0.4025
Brugia malayi ecdysteroid receptor 0.0381 0.18 0.18
Echinococcus granulosus nuclear receptor 2DBD gamma 0.018 0.065 0.065
Loa Loa (eye worm) calpain 5 0.0192 0.072 0.0702
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0381 0.18 0.18
Entamoeba histolytica calpain family cysteine protease, putative 0.0083 0.0095 0.1322
Brugia malayi calpain family protein 1 0.0728 0.3779 0.3779
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Leishmania major kinesin, putative 0.0192 0.072 0.2194
Echinococcus granulosus calpain 5 0.0275 0.1191 0.1191
Echinococcus multilocularis thyroid hormone receptor alpha 0.0381 0.18 0.18
Loa Loa (eye worm) hypothetical protein 0.0453 0.2212 0.2196
Echinococcus granulosus microtubule associated protein 2 0.0809 0.4242 0.4242
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Plasmodium vivax vivapain-2 0.0077 0.0062 0.0517
Brugia malayi photoreceptor-specific nuclear receptor 0.0381 0.18 0.18
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0381 0.18 0.18
Echinococcus granulosus thyroid hormone receptor alpha 0.018 0.065 0.065
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.0062 0.0201
Entamoeba histolytica calpain large subunit domain III containing protein 0.0192 0.072 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0077 0.0062 0.0201
Schistosoma mansoni RAR-like nuclear receptor 0.0381 0.18 0.18
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Loa Loa (eye worm) nuclear receptor nhr-7B 0.018 0.065 0.0632
Echinococcus multilocularis Nuclear hormone receptor HR96 0.018 0.065 0.065
Trypanosoma cruzi calpain cysteine peptidase, putative 0.0275 0.1191 0.1191
Brugia malayi ecdysone receptor 0.018 0.065 0.065
Echinococcus granulosus family C2 unassigned peptidase C02 family 0.0771 0.4025 0.4025
Brugia malayi Cathepsin L-like precursor 0.0077 0.0062 0.0062
Echinococcus granulosus cathepsin l1 0.0069 0.002 0.002
Trichomonas vaginalis calpain, putative 0.0083 0.0095 0.0311
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Echinococcus multilocularis cysteine protease 0.0077 0.0062 0.0062
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0077 0.0062 0.0201
Leishmania major calpain, putative,cysteine peptidase, Clan CA, family C2, putative 0.0275 0.1191 0.3763
Echinococcus multilocularis calpain family protein 1, d 0.0536 0.2683 0.2683
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0381 0.18 0.18
Entamoeba histolytica cysteine proteinase, putative 0.0077 0.0062 0.0855
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0201 0.0773 0.0773
Loa Loa (eye worm) calpain D 0.0083 0.0095 0.0076
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.018 0.065 0.065
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0381 0.18 0.1784
Echinococcus multilocularis calpain 5 0.0275 0.1191 0.1191
Loa Loa (eye worm) ctsf protein 0.0077 0.0062 0.0042
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0381 0.18 0.18
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like 0.0603 0.3064 1
Brugia malayi Cathepsin L-like precursor 0.0077 0.0062 0.0062
Echinococcus granulosus nuclear receptor nhr 48 0.018 0.065 0.065
Giardia lamblia Cathepsin B precursor 0.0603 0.3064 0.5
Echinococcus granulosus cathepsin b 0.1818 1 1
Brugia malayi Cathepsin L-like precursor 0.0077 0.0062 0.0062
Onchocerca volvulus Cathepsin L homolog 0.0077 0.0062 0.0192
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0201 0.0773 0.0773
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0095
Brugia malayi Papain family cysteine protease containing protein 0.0077 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0201 0.0773 0.0755
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.018 0.065 0.065
Echinococcus multilocularis calpain 7 (C02 family) 0.0275 0.1191 0.1191
Schistosoma mansoni cathepsin F (C01 family) 0.0069 0.002 0.002
Schistosoma mansoni Mername-AA248 (C02 family) 0.0275 0.1191 0.1191
Echinococcus multilocularis Nuclear hormone receptor HR96 0.018 0.065 0.065
Loa Loa (eye worm) hypothetical protein 0.0201 0.0773 0.0755
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0381 0.18 0.18
Brugia malayi Nuclear hormone receptor-like 1 0.0381 0.18 0.18
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0381 0.18 0.18
Trypanosoma brucei calpain-like protein, putative 0.0275 0.1191 0.3888
Schistosoma mansoni zinc finger protein 0.018 0.065 0.065
Loa Loa (eye worm) hypothetical protein 0.0381 0.18 0.1784
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0381 0.18 0.18
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0083 0.0095 0.0095
Brugia malayi Cathepsin L-like precursor 0.0077 0.0062 0.0062
Entamoeba histolytica cysteine protease, putative 0.0077 0.0062 0.0855
Brugia malayi Steroid receptor seven-up type 2 0.0381 0.18 0.18
Leishmania major hypothetical protein, conserved 0.0083 0.0095 0.0112
Trypanosoma brucei Calpain-like protein 2 0.0083 0.0095 0.0311
Loa Loa (eye worm) hypothetical protein 0.0201 0.0773 0.0755
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0077 0.0062 0.0062
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0077 0.0062 0.0201
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Echinococcus multilocularis cysteine protease 0.0077 0.0062 0.0062
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Trypanosoma cruzi cysteine peptidase, putative 0.0077 0.0062 0.0062
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.0062 0.0201
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0077 0.0062 0.0042
Loa Loa (eye worm) calpain 0.0275 0.1191 0.1174
Leishmania major calpain family cysteine protease-like protein 0.0083 0.0095 0.0112
Echinococcus multilocularis family C2 unassigned peptidase (C02 family) 0.0771 0.4025 0.4025
Brugia malayi nuclear receptor NHR-67 0.018 0.065 0.065
Echinococcus granulosus calpain A 0.0771 0.4025 0.4025
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.018 0.065 0.2878
Echinococcus multilocularis nuclear receptor nhr 48 0.018 0.065 0.065
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0381 0.18 0.1784
Echinococcus granulosus expressed protein 0.0438 0.2122 0.2122
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Trypanosoma cruzi cytoskeleton-associated protein CAP5.5, putative 0.0083 0.0095 0.0095
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.0062 0.0201
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0275 0.1191 0.1191
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.0062 0.0201
Onchocerca volvulus 0.0453 0.2212 1
Echinococcus multilocularis hypothetical protein 0.0275 0.1191 0.1191
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Trypanosoma cruzi kinesin, putative 0.0192 0.072 0.072
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0381 0.18 0.18
Leishmania major calpain protease-like protein 0.0083 0.0095 0.0112
Echinococcus granulosus calpain A 0.0275 0.1191 0.1191
Trypanosoma brucei cysteine peptidase C (CPC) 0.0603 0.3064 1
Trypanosoma cruzi cysteine peptidase, putative 0.0077 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0381 0.18 0.1784
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Loa Loa (eye worm) hypothetical protein 0.0201 0.0773 0.0755
Trypanosoma cruzi centrin, putative 0.0095 0.0166 0.0166
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0381 0.18 0.1784
Trypanosoma cruzi kinesin, putative 0.0192 0.072 0.072
Brugia malayi Cathepsin L-like precursor 0.0069 0.002 0.002
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0381 0.18 0.18
Trichomonas vaginalis Clan CA, family C2, calpain-like cysteine peptidase 0.0083 0.0095 0.0311
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0381 0.18 0.18
Echinococcus multilocularis cathepsin b 0.1818 1 1
Schistosoma mansoni nuclear receptor nhr-48 0.018 0.065 0.065
Trypanosoma brucei cysteine peptidase, Clan CA, family C2, putative 0.0275 0.1191 0.3888
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Trypanosoma cruzi cytoskeleton-associated protein CAP5.5, putative 0.0083 0.0095 0.0095
Brugia malayi hypothetical protein 0.018 0.065 0.065
Echinococcus multilocularis microtubule associated protein 2 0.0809 0.4242 0.4242
Loa Loa (eye worm) hypothetical protein 0.0381 0.18 0.1784
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0381 0.18 0.8121
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0381 0.18 0.18
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0201 0.0773 0.0773
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0095
Schistosoma mansoni nuclear hormone receptor 0.018 0.065 0.065
Schistosoma mansoni calpain C (C02 family) 0.0275 0.1191 0.1191
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0381 0.18 0.18
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Echinococcus granulosus ecdysone induced protein 78C 0.0381 0.18 0.18
Loa Loa (eye worm) nuclear hormone receptor 0.018 0.065 0.0632
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0771 0.4025 0.4025
Schistosoma mansoni nuclear hormone receptor 0.018 0.065 0.065
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.1818 1 1
Trypanosoma brucei calpain-like protein, putative 0.0275 0.1191 0.3888
Trypanosoma cruzi calpain cysteine peptidase, putative 0.0083 0.0095 0.0095
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0095
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0077 0.0062 0.0201
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0077 0.0062 0.0201
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0275 0.1191 0.1191
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0077 0.0062 0.0062
Brugia malayi Nuclear hormone receptor E75 0.018 0.065 0.065
Brugia malayi calpain 7 0.0275 0.1191 0.1191
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0603 0.3064 0.3064
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0381 0.18 0.18
Schistosoma mansoni retinoic acid receptor RXR 0.0381 0.18 0.18
Loa Loa (eye worm) hypothetical protein 0.0381 0.18 0.1784
Loa Loa (eye worm) hypothetical protein 0.0728 0.3779 0.3767
Brugia malayi Nuclear hormone receptor-like 1 0.0201 0.0773 0.0773
Plasmodium falciparum cysteine proteinase falcipain 3 0.0077 0.0062 0.6469
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0603 0.3064 0.3064
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0275 0.1191 0.1191
Trypanosoma brucei calpain, putative 0.0083 0.0095 0.0311
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0069 0.002 0.002
Schistosoma mansoni thyroid hormone receptor 0.0381 0.18 0.18
Trypanosoma brucei glucosamine 6-phosphate n-acetyltransferase 0.0083 0.0095 0.0311
Echinococcus granulosus programmed cell death protein 0.0095 0.0166 0.0166
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0381 0.18 0.18
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.018 0.065 0.2878
Entamoeba histolytica cysteine proteinase, putative 0.0077 0.0062 0.0855
Echinococcus granulosus Nuclear hormone receptor HR96 0.018 0.065 0.065
Loa Loa (eye worm) cathepsin B 0.0603 0.3064 0.305
Echinococcus multilocularis cathepsin L cysteine protease 0.0077 0.0062 0.0062
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.0062 0.0201
Plasmodium vivax vivapain-2 0.0077 0.0062 0.0517
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0381 0.18 0.18
Loa Loa (eye worm) hypothetical protein 0.0201 0.0773 0.0755
Brugia malayi nuclear receptor NHR-88 0.0381 0.18 0.18
Brugia malayi nuclear receptor RXR 0.018 0.065 0.065
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0083 0.0095 0.0095
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0077 0.0062 0.0201
Brugia malayi Cathepsin L-like precursor 0.0077 0.0062 0.0062
Trypanosoma brucei cysteine peptidase, putative 0.0083 0.0095 0.0311
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.1818 1 1
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0275 0.1191 0.3763
Brugia malayi hypothetical protein 0.0201 0.0773 0.0773
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.0062 0.0201
Brugia malayi tailless protein 0.018 0.065 0.065
Trypanosoma brucei calpain-like protein, putative 0.0275 0.1191 0.3888
Onchocerca volvulus Bile acid receptor homolog 0.0381 0.18 0.8121
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Schistosoma mansoni hypothetical protein 0.0169 0.0586 0.0586
Onchocerca volvulus 0.018 0.065 0.2878
Brugia malayi Cathepsin L-like precursor 0.0069 0.002 0.002
Schistosoma mansoni calpain-7 (C02 family) 0.0275 0.1191 0.1191
Trypanosoma brucei cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0311
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0381 0.18 0.18
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0275 0.1191 0.1191
Brugia malayi hypothetical protein 0.0201 0.0773 0.0773
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0381 0.18 0.18
Echinococcus multilocularis programmed cell death protein 0.0095 0.0166 0.0166
Trichomonas vaginalis Clan CA, family C2, calpain-like cysteine peptidase 0.0083 0.0095 0.0311
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0095
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0083 0.0095 0.0095
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0275 0.1191 0.1191
Schistosoma mansoni calpain (C02 family) 0.0275 0.1191 0.1191
Trichomonas vaginalis hypothetical protein 0.0083 0.0095 0.0311
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0083 0.0095 0.0311
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0077 0.0062 0.0201
Schistosoma mansoni thyroid hormone receptor 0.0381 0.18 0.18
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Echinococcus multilocularis calpain 0.0275 0.1191 0.1191
Trypanosoma brucei calpain-like protein, putative 0.0275 0.1191 0.3888
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Trichomonas vaginalis calpain, putative 0.0083 0.0095 0.0311
Echinococcus granulosus calpain 0.0275 0.1191 0.1191
Onchocerca volvulus 0.0077 0.0062 0.0192
Echinococcus multilocularis calpain A 0.0771 0.4025 0.4025
Brugia malayi hypothetical protein 0.018 0.065 0.065
Trypanosoma brucei calpain, putative 0.0083 0.0095 0.0311
Brugia malayi nuclear hormone receptor family member odr-7 0.018 0.065 0.065
Echinococcus granulosus cathepsin L cysteine proteinase 0.0077 0.0062 0.0062
Echinococcus granulosus Nuclear hormone receptor HR96 0.018 0.065 0.065
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0381 0.18 0.18
Echinococcus granulosus FTZ F1 alpha 0.0381 0.18 0.18
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.0062 0.0201
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Trypanosoma cruzi cysteine peptidase, putative 0.0077 0.0062 0.0062
Schistosoma mansoni nuclear receptor 0.018 0.065 0.065
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.0062 0.0201
Giardia lamblia Cathepsin B precursor 0.0603 0.3064 0.5
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0083 0.0095 0.0095
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Brugia malayi Nuclear hormone receptor E75 0.018 0.065 0.065
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Trypanosoma brucei cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0311
Trypanosoma brucei cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0311
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0069 0.002 0.0064
Brugia malayi nuclear hormone receptor family member nhr-6 0.018 0.065 0.065
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Loa Loa (eye worm) DR-78 0.018 0.065 0.0632
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0275 0.1191 0.3888
Loa Loa (eye worm) cysteine protease 0.0077 0.0062 0.0042
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0095
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.018 0.065 0.065
Brugia malayi Cathepsin L-like cysteine proteinase 0.0069 0.002 0.002
Trichomonas vaginalis Clan CA, family C2, calpain-like cysteine peptidase 0.0083 0.0095 0.0311
Brugia malayi Cathepsin L-like precursor 0.0077 0.0062 0.0062
Onchocerca volvulus 0.0077 0.0062 0.0192
Plasmodium falciparum calpain 0.0083 0.0095 1
Loa Loa (eye worm) hypothetical protein 0.018 0.065 0.0632
Entamoeba histolytica grainin 2 0.0095 0.0166 0.2299
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0381 0.18 0.18
Trypanosoma brucei hypothetical protein 0.0083 0.0095 0.0311
Brugia malayi calpain D 0.0083 0.0095 0.0095
Echinococcus granulosus calpain 7 C02 family 0.0275 0.1191 0.1191
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0381 0.18 0.18
Brugia malayi conserved hypotetical protein 0.018 0.065 0.065
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.1818 1 1
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0201 0.0773 0.0773
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0381 0.18 0.1784
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Trypanosoma brucei Calpain-like protein 1.2 0.0083 0.0095 0.0311
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0077 0.0062 0.0201
Loa Loa (eye worm) fibroinase 0.0077 0.0062 0.0042
Loa Loa (eye worm) hypothetical protein 0.0536 0.2683 0.2668
Leishmania major calpain-like protein, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0077 0.0062 0.6469
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0381 0.18 0.18
Schistosoma mansoni microtubule-associated protein tau 0.0809 0.4242 0.4242
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.0062 0.0201
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0381 0.18 0.1784
Trichomonas vaginalis calmodulin, putative 0.0095 0.0166 0.054
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.018 0.065 0.065
Echinococcus multilocularis cathepsin b 0.1818 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0077 0.0062 0.0201
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.018 0.065 0.065
Leishmania major cytoskeleton-associated protein CAP5.5, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0095
Onchocerca volvulus 0.0077 0.0062 0.0192
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0603 0.3064 1
Echinococcus granulosus cathepsin l1 0.0077 0.0062 0.0062
Trichomonas vaginalis Clan CA, family C2, calpain-like cysteine peptidase 0.0083 0.0095 0.0311
Trypanosoma brucei Calpain-like protein 1.1 0.0083 0.0095 0.0311
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.018 0.065 0.065
Loa Loa (eye worm) hypothetical protein 0.1818 1 1
Entamoeba histolytica cysteine proteinase, putative 0.0069 0.002 0.0272
Trichomonas vaginalis calpain, putative 0.0083 0.0095 0.0311
Loa Loa (eye worm) calpain family protein 1 0.0728 0.3779 0.3767
Trichomonas vaginalis calcium binding protein, putative 0.0095 0.0166 0.054
Toxoplasma gondii cathepsin B 0.0603 0.3064 1
Brugia malayi nuclear hormone receptor 0.0381 0.18 0.18
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0275 0.1191 0.1191
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0112
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0381 0.18 0.18
Onchocerca volvulus 0.0077 0.0062 0.0192
Brugia malayi calpain 5 0.0083 0.0095 0.0095
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0381 0.18 0.1784
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.1818 1 1
Echinococcus multilocularis FTZ F1 alpha 0.0381 0.18 0.18
Loa Loa (eye worm) calpain family protein 1 0.0536 0.2683 0.2668
Trypanosoma cruzi centrin, putative 0.0095 0.0166 0.0166
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0381 0.18 0.18
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0077 0.0062 0.0042
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0083 0.0095 0.0095
Trypanosoma cruzi cysteine peptidase, putative 0.0077 0.0062 0.0062
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0728 0.3779 0.3779
Leishmania major hypothetical protein, unknown function 0.0083 0.0095 0.0112
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0069 0.002 0.0064

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = -5.29 Inhibition of human placental microsome CYP19 ChEMBL. 15615528
IC50 (binding) = 5.13 uM Inhibition of human placental microsome CYP19 ChEMBL. 15615528
IC50 (binding) = 5.13 uM Inhibition of human placental microsome CYP19 ChEMBL. 15615528
IC50 (binding) = 5.13 uM Inhibition of human aromatase-mediated conversion of [1beta3H]androstenedione to estrone by liquid scintillation counting in presence of NADPH ChEMBL. 19072235
Inhibition (binding) = 9 % Inhibition of human microsome CYP17 at 0.5 uM ChEMBL. 15615528
Inhibition (binding) = 9 % Inhibition of human microsome CYP17 at 0.5 uM ChEMBL. 15615528
Log IC50 (binding) = 5.29 Inhibition of human placental microsome CYP19 ChEMBL. 15615528

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

2 literature references were collected for this gene.

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