Detailed information for compound 1447841

Basic information

Technical information
  • TDR Targets ID: 1447841
  • Name: C620-0254
  • MW: 389.49 | Formula: C24H27N3O2
  • H donors: 1 H acceptors: 2 LogP: 6.08 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(c1cc(NC2CCCCC2)c2c3c1noc3c1c(C2=O)cccc1)CC
  • InChi: 1S/C24H27N3O2/c1-3-27(4-2)19-14-18(25-15-10-6-5-7-11-15)20-21-22(19)26-29-24(21)17-13-9-8-12-16(17)23(20)28/h8-9,12-15,25H,3-7,10-11H2,1-2H3
  • InChiKey: RLIJKMRSZHYFRL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • NCGC00111037-01

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens lysine (K)-specific demethylase 4A Starlite/ChEMBL No references
Homo sapiens peptidylprolyl cis/trans isomerase, NIMA-interacting 1 Starlite/ChEMBL No references
Homo sapiens bromodomain adjacent to zinc finger domain, 2B Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references
Homo sapiens chromobox homolog 1 Starlite/ChEMBL No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) heterochromatin protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma japonicum Cleft lip and palate transmembrane protein 1-like protein, putative Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma mansoni rotamase Get druggable targets OG5_128367 All targets in OG5_128367
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Echinococcus multilocularis chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus multilocularis bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma mansoni chromobox protein Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma japonicum Probable JmjC domain-containing histone demethylation protein 3B, putative Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma japonicum Conserved hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Plasmodium yoelii hypothetical protein Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma mansoni chromobox protein Get druggable targets OG5_129545 All targets in OG5_129545
Leishmania mexicana peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Schistosoma japonicum ko:K01549 ATP synthase [EC3.6.3.14], putative Get druggable targets OG5_131570 All targets in OG5_131570
Toxoplasma gondii peptidylprolyl isomerase Get druggable targets OG5_128367 All targets in OG5_128367
Schistosoma japonicum ko:K09578 peptidyl-prolyl cis-trans isomerase NIMA-interacting 1, putative Get druggable targets OG5_128367 All targets in OG5_128367
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Neospora caninum peptidyl-prolyl cis-trans isomerase NIMA- interacting 1, putative Get druggable targets OG5_128367 All targets in OG5_128367
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Echinococcus granulosus bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Babesia bovis peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Brugia malayi jmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus granulosus Transcription factor JmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Leishmania donovani peptidyl-prolyl cis-trans isomerase/rotamase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Leishmania infantum peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma mansoni jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Brugia malayi Heterochromatin protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Candida albicans peptidylprolyl cis/trans isomerase isolated by functional complementation of S. cerevisiae ESS1 (YJR017C) which interacts with t Get druggable targets OG5_128367 All targets in OG5_128367
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase Get druggable targets OG5_128367 All targets in OG5_128367
Trypanosoma brucei gambiense peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Onchocerca volvulus Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_128367 All targets in OG5_128367
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Echinococcus granulosus chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus granulosus chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma japonicum expressed protein Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Echinococcus multilocularis Transcription factor, JmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Schistosoma japonicum expressed protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase Get druggable targets OG5_128367 All targets in OG5_128367
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_129545 All targets in OG5_129545
Leishmania braziliensis peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Onchocerca volvulus Heterochromatin protein 1 homolog Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Loa Loa (eye worm) jmjC domain-containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum Chromobox protein homolog 5, putative Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus multilocularis jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Schistosoma mansoni bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Candida albicans peptidylprolyl cis/trans isomerase isolated by functional complementation of S. cerevisiae ESS1 (YJR017C) which interacts with t Get druggable targets OG5_128367 All targets in OG5_128367
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Theileria parva hypothetical protein Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus multilocularis chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus multilocularis expressed protein Get druggable targets OG5_128367 All targets in OG5_128367
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Brugia malayi Bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Trypanosoma congolense peptidyl-prolyl cis-trans isomerase/rotamase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Schistosoma japonicum hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus granulosus jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 Get druggable targets OG5_128367 All targets in OG5_128367
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma japonicum expressed protein Get druggable targets OG5_127917 All targets in OG5_127917
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase Get druggable targets OG5_128367 All targets in OG5_128367
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Theileria parva peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus granulosus expressed protein Get druggable targets OG5_128367 All targets in OG5_128367
Trichomonas vaginalis rotamase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Trichomonas vaginalis rotamase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Schistosoma japonicum JmjC domain-containing histone demethylation protein 3C, putative Get druggable targets OG5_127917 All targets in OG5_127917
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Leishmania major peptidyl-prolyl cis-trans isomerase, putative peptidylprolyl cis/trans isomerase, NIMA-interacting 1 163 aa 133 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi valosin containing protein 0.0989 0.5819 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0021 0.0013 0.0013
Onchocerca volvulus 0.0037 0.0111 0.0011
Echinococcus multilocularis chromobox protein 1 0.0084 0.0394 0.0381
Trichomonas vaginalis skd/vacuolar sorting, putative 0.0087 0.041 0.0323
Trypanosoma cruzi vacuolar protein sorting-associated protein 4, putative 0.0087 0.041 0.0432
Loa Loa (eye worm) hypothetical protein 0.0052 0.0198 0.0312
Echinococcus multilocularis chromobox protein 1 0.0084 0.0394 0.0381
Loa Loa (eye worm) fidgetin protein 0.0087 0.041 0.0677
Trypanosoma cruzi katanin-like protein, putative 0.0087 0.041 0.0432
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0172 0.0083
Loa Loa (eye worm) hypothetical protein 0.0047 0.0172 0.0267
Trypanosoma cruzi Valosin-containing protein, putative 0.16 0.9479 1
Schistosoma mansoni chromobox protein 0.0084 0.0394 0.0394
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0035 0.01 0.01
Trypanosoma brucei vacuolar protein sorting-associated protein 4, putative 0.0087 0.041 0.0432
Trypanosoma brucei katanin, putative 0.0087 0.041 0.0432
Echinococcus granulosus expressed protein 0.004 0.0131 0.0118
Entamoeba histolytica ATPase, Vps4 oligomerisation domain containing protein 0.0087 0.041 0.0304
Trypanosoma cruzi katanin, putative 0.0087 0.041 0.0432
Echinococcus granulosus vacuolar protein sorting associated protein 4A 0.0087 0.041 0.0398
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0057 0.0229 0.0216
Loa Loa (eye worm) hypothetical protein 0.0057 0.0229 0.0365
Plasmodium falciparum vacuolar protein sorting-associated protein 4 0.0087 0.041 0.033
Echinococcus multilocularis jumonji domain containing protein 0.0049 0.0183 0.017
Echinococcus multilocularis zinc finger protein 0.0024 0.0031 0.0018
Trypanosoma brucei katanin, putative 0.0087 0.041 0.0432
Entamoeba histolytica vacuolar sorting protein-associating protein 4A (VPS4), putative 0.0087 0.041 0.0304
Echinococcus granulosus lysine specific demethylase 5A 0.0045 0.0159 0.0146
Giardia lamblia Katanin 0.0087 0.041 0.053
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0072 0.0321 0.0309
Entamoeba histolytica cdc48-like protein, putative 0.16 0.9479 1
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative 0.0039 0.0125 0.0132
Leishmania major vacuolar protein sorting-associated protein 4 0.0087 0.041 0.0432
Plasmodium vivax cell division cycle ATPase, putative 0.0611 0.355 0.3678
Trichomonas vaginalis AAA ATPase, putative 0.0087 0.041 0.0323
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.1396 0.2376
Brugia malayi Pre-SET motif family protein 0.0251 0.1396 0.2307
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0698 0.407 0.407
Brugia malayi PHD-finger family protein 0.0035 0.01 0.0053
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0057 0.0229 0.0229
Schistosoma mansoni hypothetical protein 0.0035 0.01 0.01
Leishmania major Transitional endoplasmic reticulum ATPase, putative,valosin-containing protein homolog 0.16 0.9479 1
Echinococcus multilocularis fidgetin protein 1 0.0087 0.041 0.0398
Echinococcus granulosus peregrin 0.0038 0.0117 0.0105
Trypanosoma cruzi katanin, putative 0.0087 0.041 0.0432
Mycobacterium ulcerans ATPase 0.1009 0.594 0.5
Echinococcus granulosus jumonji domain containing protein 0.0049 0.0183 0.017
Schistosoma mansoni cell division control protein 48 aaa family protein 0.16 0.9479 0.9479
Trypanosoma cruzi katanin, putative 0.0087 0.041 0.0432
Leishmania major katanin, putative,serine peptidase, Clan SJ, family S16, putative 0.0087 0.041 0.0432
Giardia lamblia Topoisomerase II 0.0087 0.041 0.053
Toxoplasma gondii katanin-like family protein 0.0087 0.041 0.0313
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0039 0.0125 0.0132
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.4884 0.4884
Loa Loa (eye worm) hypothetical protein 0.0037 0.0111 0.0162
Trypanosoma cruzi vacuolar transport protein 4A, putative 0.0087 0.041 0.0432
Brugia malayi Bromodomain containing protein 0.0091 0.0432 0.0631
Loa Loa (eye worm) hypothetical protein 0.006 0.0251 0.0403
Loa Loa (eye worm) vps4b-prov protein 0.0087 0.041 0.0677
Brugia malayi Bromodomain containing protein 0.0038 0.0117 0.0083
Brugia malayi ATPase, AAA family protein 0.0087 0.041 0.0592
Schistosoma mansoni jumonji domain containing protein 0.0092 0.0438 0.0438
Schistosoma mansoni cell division control protein 48 aaa family protein 0.1687 1 1
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0051 0.0193 0.0094
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0172 0.0083
Echinococcus multilocularis transitional endoplasmic reticulum atpase 0.0698 0.407 0.4063
Trypanosoma cruzi metalloprotease, putative 0.0087 0.041 0.0432
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.4884 0.4878
Brugia malayi Bromodomain containing protein 0.0046 0.0166 0.0169
Echinococcus granulosus zinc finger protein 0.0024 0.0031 0.0018
Trichomonas vaginalis chromobox protein, putative 0.0051 0.0193 0.0105
Loa Loa (eye worm) jmjC domain-containing protein 0.0073 0.0325 0.0531
Schistosoma mansoni zinc finger protein 0.0024 0.0031 0.0031
Entamoeba histolytica transitional endoplasmic reticulum ATPase, putative 0.16 0.9479 1
Echinococcus multilocularis lysine specific demethylase 5A 0.0043 0.0145 0.0132
Trichomonas vaginalis skd/vacuolar sorting, putative 0.0087 0.041 0.0323
Brugia malayi fidgetin protein 0.0087 0.041 0.0592
Echinococcus multilocularis katanin p60 ATPase containing subunit A1 0.0087 0.041 0.0398
Loa Loa (eye worm) hypothetical protein 0.0085 0.0401 0.0662
Echinococcus granulosus chromobox protein 1 0.0084 0.0394 0.0381
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 0.004 0.0131 0.0107
Echinococcus multilocularis vacuolar protein sorting associated protein 4A 0.0087 0.041 0.0398
Schistosoma mansoni hypothetical protein 0.0025 0.0039 0.0039
Echinococcus granulosus PHD finger protein rhinoceros 0.0035 0.01 0.0088
Brugia malayi jmjC domain containing protein 0.0045 0.0159 0.0155
Trypanosoma brucei metalloprotease, putative 0.0087 0.041 0.0432
Plasmodium vivax SET domain protein, putative 0.0036 0.0105 0.0005
Trypanosoma brucei vesicular transport protein (CDC48 homologue), putative 0.0087 0.041 0.0432
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0057 0.0229 0.0229
Onchocerca volvulus Transitional endoplasmic reticulum ATPase homolog 0.1687 1 1
Trypanosoma brucei Valosin-containing protein 0.16 0.9479 1
Trichomonas vaginalis 26S protease regulatory subunit S10b, putative 0.0399 0.228 0.221
Giardia lamblia AAA family ATPase 0.1009 0.594 1
Trypanosoma cruzi katanin, putative 0.0087 0.041 0.0432
Echinococcus granulosus microtubule associated protein 2 0.0833 0.4884 0.4878
Trypanosoma cruzi katanin, putative 0.0087 0.041 0.0432
Trichomonas vaginalis chromobox protein, putative 0.0084 0.0394 0.0307
Schistosoma mansoni rotamase 0.004 0.0131 0.0131
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase 0.004 0.0131 0.0196
Trichomonas vaginalis set domain proteins, putative 0.0286 0.1604 0.1528
Onchocerca volvulus 0.0286 0.1604 0.1519
Loa Loa (eye worm) PHD-finger family protein 0.0025 0.0039 0.0037
Toxoplasma gondii transitional endoplasmic reticulum ATPase, putative 0.1009 0.594 0.5899
Toxoplasma gondii cell division protein CDC48CY 0.1687 1 1
Echinococcus multilocularis transitional endoplasmic reticulum atpase 0.1687 1 1
Giardia lamblia SKD1 protein 0.0087 0.041 0.053
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.005 0.0188 0.0188
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0027 0.0052 0.0052
Trichomonas vaginalis AAA ATPase, putative 0.0087 0.041 0.0323
Trichomonas vaginalis proteasome-activating nucleotidase, putative 0.0399 0.228 0.221
Toxoplasma gondii peptidylprolyl isomerase 0.0039 0.0125 0.0025
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative 0.0039 0.0125 0.0132
Trichomonas vaginalis chromobox protein, putative 0.0051 0.0193 0.0105
Schistosoma mansoni skd/vacuolar sorting 0.0087 0.041 0.041
Trichomonas vaginalis conserved hypothetical protein 0.004 0.0131 0.0042
Onchocerca volvulus 0.005 0.0188 0.0088
Loa Loa (eye worm) heterochromatin protein 1 0.0084 0.0394 0.0649
Schistosoma mansoni bromodomain containing protein 0.0076 0.0347 0.0347
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0039 0.0125 0.0132
Loa Loa (eye worm) hypothetical protein 0.0049 0.0184 0.0288
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0043 0.0149 0.0137
Brugia malayi SAP1 protein 0.0087 0.041 0.0592
Mycobacterium tuberculosis Putative conserved ATPase 0.1009 0.594 0.5
Brugia malayi transitional endoplasmic reticulum ATPase TER94, putative 0.0698 0.407 0.6959
Echinococcus granulosus fidgetin protein 1 0.0087 0.041 0.0398
Brugia malayi vesicle-fusing ATPase 0.0989 0.5819 1
Leishmania major katanin-like protein,serine peptidase, Clan SJ, family S16, putative 0.0087 0.041 0.0432
Trichomonas vaginalis rotamase, putative 0.0039 0.0125 0.0036
Echinococcus multilocularis peregrin 0.0038 0.0117 0.0105
Schistosoma mansoni hypothetical protein 0.0087 0.041 0.041
Plasmodium falciparum cell division cycle protein 48 homologue, putative 0.16 0.9479 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0043 0.0149 0.0137
Echinococcus granulosus katanin p60 ATPase containing subunit A1 0.0087 0.041 0.0398
Loa Loa (eye worm) vesicle-fusing ATPase 0.0989 0.5819 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0072 0.0321 0.0309
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0105 0.0105
Loa Loa (eye worm) PHD-finger family protein 0.0035 0.01 0.0143
Leishmania major katanin-like protein,serine peptidase, Clan SJ, family S16, putative 0.0087 0.041 0.0432
Loa Loa (eye worm) hypothetical protein 0.0035 0.01 0.0143
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0115 0.058 0.0568
Schistosoma mansoni methyl-cpg binding protein mbd 0.0021 0.0013 0.0013
Trypanosoma brucei katanin, putative 0.0087 0.041 0.0432
Trichomonas vaginalis spastin, putative 0.0087 0.041 0.0323
Echinococcus multilocularis PHD finger protein rhinoceros 0.0035 0.01 0.0088
Giardia lamblia SKD1 protein 0.0087 0.041 0.053
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.0105 0.0093
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0115 0.058 0.0568
Loa Loa (eye worm) jmjC domain-containing protein 0.0045 0.0159 0.0244
Loa Loa (eye worm) hypothetical protein 0.0989 0.5819 1
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0047 0.0172 0.0072
Brugia malayi jmjC domain containing protein 0.0115 0.058 0.0889
Brugia malayi Heterochromatin protein 1 0.0084 0.0394 0.0564
Schistosoma mansoni chromobox protein 0.0084 0.0394 0.0394
Trypanosoma cruzi vesicular transport protein (CDC48 homologue), putative 0.0087 0.041 0.0432
Echinococcus granulosus histone lysine methyltransferase setb 0.0057 0.0229 0.0216
Loa Loa (eye worm) VCP protein 0.0698 0.407 0.6986
Loa Loa (eye worm) hypothetical protein 0.0046 0.0167 0.0258
Trypanosoma cruzi katanin-like protein, putative 0.0087 0.041 0.0432
Plasmodium vivax cell division cycle protein 48 homologue, putative 0.16 0.9479 1
Toxoplasma gondii cell division protein CDC48AP 0.1009 0.594 0.5899
Echinococcus granulosus chromobox protein 1 0.0084 0.0394 0.0381
Trichomonas vaginalis rotamase, putative 0.004 0.0131 0.0042
Echinococcus granulosus fetal alzheimer antigen falz 0.0027 0.0052 0.004
Schistosoma mansoni jumonji/arid domain-containing protein 0.0045 0.0159 0.0159
Echinococcus multilocularis expressed protein 0.004 0.0131 0.0118
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.0105 0.0005
Trichomonas vaginalis spermatogenesis associated factor, putative 0.1687 1 1
Trypanosoma brucei katanin, putative 0.0087 0.041 0.0432
Loa Loa (eye worm) ATPase 0.0087 0.041 0.0677
Brugia malayi Pre-SET motif family protein 0.0036 0.0105 0.0062
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0035 0.0097 0.0085
Brugia malayi vps4b-prov protein 0.0087 0.041 0.0592
Schistosoma mansoni jumonji/arid domain-containing protein 0.0045 0.0159 0.0159
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0027 0.0052 0.004
Trichomonas vaginalis chromobox protein, putative 0.0084 0.0394 0.0307
Brugia malayi chromobox protein homolog 3 0.0047 0.0172 0.0178

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 3.5481 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 7.0795 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 7.9433 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 8.9125 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (binding) = 11.2202 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) = 14.1254 um PUBCHEM_BIOASSAY: Counterscreen qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. This assay monitors tau fibrillation by fluorescence polarization (FP) of Alexa 594-labeled K18 P301L, which does not fibrillize readily but incorporates into growing filaments of unlabeled tau. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 17.7828 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Vif-A3F Interactions: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 31.6228 uM PubChem BioAssay. qHTS of Trypanosoma Brucei Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. Inhibitors of USP1/UAF1: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (without detergent). (Class of assay: confirmatory) [Related pubchem assays: 2158 (Confirmation qHTS Assay for Inhibitors of Cruzain), 2249 (Probe Development Summary of Promiscuous Inhibitors (Artifacts) of Cruzain), 2161 (qHTS Assay for Inhibitors of Papain: Counterscreen for Cruzain Assay), 1478 (qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (with detergent))] ChEMBL. No reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 50.1187 uM PUBCHEM_BIOASSAY: Inhibitors of Regulator of G Protein Signaling (RGS) 4: qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504856] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: Inhibitors of the vitamin D receptor (VDR): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504855] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

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

No literature references available for this target.

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