Detailed information for compound 984761

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 376.486 | Formula: C22H32O5
  • H donors: 1 H acceptors: 4 LogP: 3.58 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)O[C@@H]1C[C@H]2CC(=O)[C@@]3(C[C@@]2([C@@]2([C@@H]1[C@@](C)(CCC2)C(=O)O)C)CC3)C
  • InChi: 1S/C22H32O5/c1-13(23)27-15-10-14-11-16(24)19(2)8-9-22(14,12-19)21(4)7-5-6-20(3,17(15)21)18(25)26/h14-15,17H,5-12H2,1-4H3,(H,25,26)/t14-,15+,17-,19-,20+,21-,22-/m0/s1
  • InChiKey: OJVJNLLWLPJWDF-VDWPZXQQSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni histone deacetylase 0.0075 0.0622 0.1227
Brugia malayi cytoplasmic intermediate filament protein 0.0028 0.0064 0.0088
Echinococcus granulosus Carboxy terminal domain RNA polymerase II 0.0026 0.0035 0.0069
Schistosoma mansoni histone deacetylase 0.0075 0.0622 0.1227
Trypanosoma cruzi sterol 24-c-methyltransferase, putative 0.0397 0.4471 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0039 0.0189 0.0259
Leishmania major sterol 24-c-methyltransferase, putative 0.0397 0.4471 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0064 0.0498 1
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0051 0.0333 0.0325
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0149 0.1511 0.1511
Mycobacterium tuberculosis Halimadienyl diphosphate synthase 0.0092 0.0825 1
Echinococcus multilocularis histone deacetylase 1 0.0075 0.0622 0.0622
Plasmodium falciparum JmjC domain-containing protein, putative 0.0027 0.0048 0.0773
Brugia malayi hypothetical protein 0.0237 0.2553 0.3503
Loa Loa (eye worm) hypothetical protein 0.0237 0.2553 0.3503
Loa Loa (eye worm) jmjC domain-containing protein 0.0064 0.0495 0.0679
Schistosoma mansoni nuclear lim interactor-interacting factor (nli-interacting factor) (nli-if) 0.0026 0.0035 0.0069
Schistosoma mansoni jumonji domain containing protein 0.0027 0.0048 0.0095
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.007 0.0565 0.1264
Echinococcus granulosus transcription factor Dp 1 0.0041 0.0213 0.042
Echinococcus granulosus phd:f box containing protein 0.0027 0.0048 0.0095
Schistosoma mansoni phosphatidylserine receptor 0.0027 0.0048 0.0095
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0039 0.0189 0.0422
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0039 0.0197 1
Trichomonas vaginalis histone deacetylase, putative 0.0075 0.0622 0.1155
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0039 0.0197 0.3162
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.007 0.0565 0.5121
Loa Loa (eye worm) inositol-1 0.0039 0.0197 0.027
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0073 0.0599 0.0599
Loa Loa (eye worm) jmjC domain-containing protein 0.01 0.0926 0.127
Brugia malayi Intermediate filament tail domain containing protein 0.0052 0.0355 0.0487
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0058 0.0416 0.082
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.01 0.1602
Toxoplasma gondii exonuclease III APE 0.0038 0.0185 0.2972
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0038 0.0185 0.2972
Brugia malayi exodeoxyribonuclease III family protein 0.0038 0.0185 0.0254
Loa Loa (eye worm) vesicular acetylcholine transporter unc-17 0.0448 0.5071 0.6958
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0075 0.0619 0.085
Brugia malayi jmjC domain containing protein 0.0027 0.0048 0.0066
Echinococcus granulosus histone deacetylase 1 0.0075 0.0622 0.1227
Trypanosoma cruzi histone deacetylase 1, putative 0.0075 0.0622 0.1392
Echinococcus multilocularis vesicular acetylcholine transporter 0.0448 0.5071 0.5071
Toxoplasma gondii histone lysine demethylase JMJD6a 0.0027 0.0048 0.0773
Loa Loa (eye worm) hypothetical protein 0.007 0.0564 0.0774
Onchocerca volvulus 0.0052 0.0355 0.0355
Echinococcus granulosus histone acetyltransferase MYST2 0.0058 0.0417 0.0822
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0075 0.0619 0.1221
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0075 0.0622 0.1155
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0094 0.0856 0.0856
Brugia malayi histone deacetylase 1 (HD1) 0.0075 0.0622 0.0854
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.007 0.0565 0.0565
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0039 0.0197 0.044
Echinococcus granulosus JmjC domain containing protein 4 0.0027 0.0048 0.0095
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0073 0.0599 0.1182
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0094 0.0856 0.1175
Echinococcus granulosus survival motor neuron protein 1 0.0237 0.2553 0.5034
Schistosoma mansoni phd/f-box containing protein 0.0027 0.0048 0.0095
Schistosoma mansoni inositol monophosphatase 0.0039 0.0197 0.0388
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0038 0.0185 0.055
Loa Loa (eye worm) hypothetical protein 0.0031 0.01 0.0137
Loa Loa (eye worm) acetyltransferase 0.0149 0.1511 0.2073
Loa Loa (eye worm) hypothetical protein 0.0025 0.0031 0.0043
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.006 0.0442 0.0872
Schistosoma mansoni transcription factor LCR-F1 0.0073 0.0599 0.1182
Schistosoma mansoni vesicular acetylcholine transporter 0.0448 0.5071 1
Echinococcus multilocularis lamin 0.0052 0.0355 0.0355
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0039 0.0197 0.0377
Trichomonas vaginalis dullard protein, putative 0.0026 0.0035 0.0065
Schistosoma mansoni jumonji/arid domain-containing protein 0.01 0.0926 0.1825
Leishmania major histone deacetylase, putative 0.0075 0.0622 0.1392
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0115 0.1103 0.1514
Brugia malayi jmjC domain containing protein 0.01 0.0926 0.127
Brugia malayi histone deacetylase 3 (HD3) 0.0075 0.0622 0.0854
Echinococcus granulosus vesicular acetylcholine transporter 0.0448 0.5071 1
Echinococcus granulosus jumonji domain containing 1A 0.0027 0.0048 0.0095
Plasmodium vivax JmjC domain containing protein 0.0027 0.0048 0.0773
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0416 0.47 0.6449
Entamoeba histolytica hypothetical protein 0.0073 0.0599 0.5433
Plasmodium vivax NLI interacting factor-like phosphatase, putative 0.0026 0.0035 0.0561
Trichomonas vaginalis nuclear lim interactor-interacting factor, putative 0.0026 0.0035 0.0065
Echinococcus granulosus lysine specific demethylase 6a 0.0027 0.0048 0.0095
Loa Loa (eye worm) hypothetical protein 0.0051 0.0333 0.0457
Brugia malayi Bromodomain containing protein 0.0035 0.0143 0.0197
Echinococcus granulosus lysine specific demethylase 5A 0.01 0.0926 0.1825
Loa Loa (eye worm) hypothetical protein 0.0027 0.0048 0.0066
Trichomonas vaginalis histone deacetylase, putative 0.0075 0.0622 0.1155
Brugia malayi hypothetical protein 0.0073 0.0599 0.0823
Leishmania major histone deacetylase, putative 0.0075 0.0622 0.1392
Brugia malayi acetyltransferase, GNAT family protein 0.0149 0.1511 0.2073
Onchocerca volvulus 0.0048 0.0305 0.0286
Entamoeba histolytica hypothetical protein 0.0092 0.0823 0.7456
Trypanosoma cruzi lanosterol synthase, putative 0.0166 0.1709 0.3823
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0027 0.0048 0.0108
Brugia malayi mbt repeat family protein 0.0051 0.0333 0.0457
Plasmodium vivax histone deacetylase 1, putative 0.0075 0.0622 1
Schistosoma mansoni hypothetical protein 0.0031 0.01 0.0197
Loa Loa (eye worm) hypothetical protein 0.0025 0.0031 0.0043
Schistosoma mansoni hypothetical protein 0.0048 0.0305 0.0601
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.01 0.1602
Schistosoma mansoni jumonji domain containing protein 0.0143 0.1442 0.2843
Schistosoma mansoni nuclear lim interactor-interacting factor (nli-interacting factor) (nli-if) 0.0026 0.0035 0.0069
Loa Loa (eye worm) mbt repeat family protein 0.0051 0.0333 0.0457
Loa Loa (eye worm) hypothetical protein 0.0052 0.0355 0.0487
Onchocerca volvulus Vesicular acetylcholine transporter homolog 0.0448 0.5071 0.6916
Loa Loa (eye worm) hypothetical protein 0.0027 0.0048 0.0066
Loa Loa (eye worm) PHD-finger family protein 0.0031 0.01 0.0137
Loa Loa (eye worm) hypothetical protein 0.0075 0.0622 0.0854
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0207 0.2202 0.4342
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0039 0.0189 0.035
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0094 0.0856 0.1689
Trypanosoma cruzi sterol 24-c-methyltransferase, putative 0.0397 0.4471 1
Echinococcus multilocularis phd:f box containing protein 0.0027 0.0048 0.0048
Echinococcus multilocularis 0.0026 0.0035 0.0035
Trypanosoma brucei sterol 24-c-methyltransferase, putative 0.0397 0.4471 1
Schistosoma mansoni aldehyde dehydrogenase 0.0064 0.0498 0.0982
Entamoeba histolytica hypothetical protein 0.0073 0.0599 0.5433
Echinococcus multilocularis geminin 0.0166 0.1709 0.1709
Echinococcus multilocularis lamin dm0 0.0052 0.0355 0.0355
Giardia lamblia Histone deacetylase 0.0075 0.0622 1
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.0333 0.0657
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.0333 0.0657
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0048 0.0305 0.0418
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0027 0.0048 0.0108
Schistosoma mansoni intermediate filament proteins 0.0052 0.0355 0.07
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.007 0.0565 0.1264
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0031 0.01 0.0197
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0044 0.0253 0.4064
Echinococcus multilocularis JmjC domain containing protein 4 0.0027 0.0048 0.0048
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0038 0.0185 0.1676
Echinococcus granulosus histone lysine methyltransferase setb 0.006 0.0442 0.0872
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0039 0.0197 0.044
Schistosoma mansoni survival motor neuron protein 0.0048 0.0305 0.0601
Brugia malayi jmjC domain containing protein 0.0027 0.0048 0.0066
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0064 0.0498 0.0982
Trypanosoma cruzi histone deacetylase 1, putative 0.0075 0.0622 0.1392
Trichomonas vaginalis dullard protein, putative 0.0026 0.0035 0.0065
Echinococcus granulosus histone acetyltransferase KAT2B 0.0044 0.0253 0.0499
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0039 0.0197 0.044
Loa Loa (eye worm) hypothetical protein 0.0026 0.0035 0.0048
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0039 0.0189 0.171
Echinococcus multilocularis peregrin 0.0035 0.0143 0.0143
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0217 0.2314 0.4563
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0207 0.2202 0.2202
Toxoplasma gondii Dullard family phosphatase domain-containing protein 0.0026 0.0035 0.0561
Trichomonas vaginalis histone deacetylase, putative 0.0075 0.0622 0.1155
Trichomonas vaginalis histone deacetylase, putative 0.0075 0.0622 0.1155
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0039 0.0189 0.0372
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0044 0.0253 0.4064
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0115 0.1103 0.2048
Schistosoma mansoni ap endonuclease 0.0038 0.0185 0.0365
Schistosoma mansoni hypothetical protein 0.0166 0.1709 0.337
Schistosoma mansoni lamin 0.0052 0.0355 0.07
Echinococcus granulosus CTD small phosphatase protein like 0.0026 0.0035 0.0069
Echinococcus multilocularis SAM and MBT domain containing protein 0.0051 0.0333 0.0333
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0039 0.0197 0.0365
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0079 0.0673 0.1249
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0038 0.0185 0.0414
Toxoplasma gondii histone lysine demethylase JMJC1/KDM5D/JARID1D 0.0027 0.0048 0.0773
Leishmania major hypothetical protein, conserved 0.0026 0.0035 0.0078
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0075 0.0619 0.0619
Trypanosoma brucei lanosterol synthase 0.0166 0.1709 0.3823
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0038 0.0185 0.0365
Schistosoma mansoni hypothetical protein 0.0073 0.0599 0.1182
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.007 0.0565 0.1114
Toxoplasma gondii histone deacetylase HDAC2 0.0075 0.0622 1
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0038 0.0185 0.0254
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0115 0.1103 1
Echinococcus granulosus inositol monophosphatase 1 0.0039 0.0197 0.0388
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0115 0.1103 0.2468
Echinococcus multilocularis polycomb protein SCMH1 0.0051 0.0333 0.0333
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0115 0.1103 0.2048
Schistosoma mansoni ap endonuclease 0.0038 0.0185 0.0365
Echinococcus multilocularis jumonji domain containing 1A 0.0027 0.0048 0.0048
Entamoeba histolytica hypothetical protein 0.0073 0.0599 0.5433
Giardia lamblia Histone acetyltransferase GCN5 0.004 0.0209 0.3363
Trichomonas vaginalis nuclear lim interactor-interacting factor, putative 0.0026 0.0035 0.0065
Plasmodium vivax SET domain protein, putative 0.006 0.0442 0.7101
Schistosoma mansoni protein phosphatase 2C 0.0027 0.0048 0.0095
Echinococcus multilocularis histone deacetylase 3 0.0075 0.0622 0.0622
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.007 0.0565 0.1264
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.006 0.0442 0.0442
Toxoplasma gondii aldehyde dehydrogenase 0.0064 0.0498 0.8002
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0075 0.0622 0.1155
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.006 0.0442 0.0872
Echinococcus multilocularis survival motor neuron protein 1 0.0237 0.2553 0.2553
Brugia malayi hypothetical protein 0.0633 0.7288 1
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0115 0.1103 0.2468
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0064 0.0498 0.5171
Giardia lamblia PHD finger protein 15 0.0031 0.01 0.1602
Loa Loa (eye worm) phosphatidylinositol 3 0.0035 0.0148 0.0203
Echinococcus multilocularis transcription factor Dp 1 0.0041 0.0213 0.0213
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0164 0.1691 0.3335
Onchocerca volvulus 0.0474 0.5387 0.7355
Loa Loa (eye worm) histone deacetylase 1 0.0075 0.0622 0.0854
Echinococcus granulosus polycomb protein SCMH1 0.0051 0.0333 0.0657
Echinococcus granulosus histone acetyltransferase KAT2B 0.0145 0.1461 0.2881
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0027 0.0048 0.0048
Echinococcus granulosus SAM and MBT domain containing protein 0.0051 0.0333 0.0657
Treponema pallidum exodeoxyribonuclease (exoA) 0.0038 0.0185 0.5
Entamoeba histolytica hypothetical protein 0.0073 0.0599 0.5433
Trypanosoma brucei Mitochondrial import inner membrane translocase subunit TIM50 0.0026 0.0035 0.0078
Onchocerca volvulus 0.006 0.0442 0.0476
Loa Loa (eye worm) histone deacetylase 3 0.0075 0.0622 0.0854
Toxoplasma gondii histone deacetylase HDAC3 0.0075 0.0622 1
Trichomonas vaginalis dullard protein, putative 0.0026 0.0035 0.0065
Echinococcus multilocularis inositol monophosphatase 1 0.0039 0.0197 0.0197
Echinococcus granulosus intermediate filament protein 0.0052 0.0355 0.07
Trichomonas vaginalis ap endonuclease, putative 0.0038 0.0185 0.0343
Brugia malayi jmjC domain containing protein 0.0027 0.0048 0.0066
Echinococcus multilocularis PHD finger protein rhinoceros 0.0031 0.01 0.01
Echinococcus multilocularis Carboxy terminal domain RNA polymerase II 0.0026 0.0035 0.0035
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0039 0.0197 0.1783
Schistosoma mansoni lamin 0.0052 0.0355 0.07
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0058 0.0417 0.0572
Trypanosoma cruzi sterol 24-c-methyltransferase, putative 0.0397 0.4471 1
Brugia malayi mbt repeat family protein 0.0051 0.0333 0.0457
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0025 0.0031 0.0061
Loa Loa (eye worm) jmjC domain-containing protein 0.0027 0.0048 0.0066
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0039 0.0189 0.171
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.007 0.0565 0.1114
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0035 0.0148 0.5
Trypanosoma brucei JmjC domain, hydroxylase, putative 0.0027 0.0048 0.0108
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0038 0.0185 0.0185
Schistosoma mansoni hypothetical protein 0.0315 0.3494 0.689
Brugia malayi Inositol-1 0.0039 0.0197 0.027
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0075 0.0622 0.1155
Brugia malayi Cytochrome P450 family protein 0.0047 0.0291 0.04
Brugia malayi S-adenosyl-methionine cycloartenol-C24-methyltransferase 0.0194 0.204 0.2799
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0038 0.0185 0.0414
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0052 0.0355 0.0487
Echinococcus granulosus PHD finger protein rhinoceros 0.0031 0.01 0.0197
Plasmodium falciparum NLI interacting factor-like phosphatase, putative 0.0026 0.0035 0.0561
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0027 0.005 0.0809
Brugia malayi Pre-SET motif family protein 0.0416 0.47 0.6449
Loa Loa (eye worm) hypothetical protein 0.006 0.0442 0.0606
Echinococcus multilocularis lysine specific demethylase 6a 0.0027 0.0048 0.0048
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0164 0.1691 0.1691
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0025 0.0031 0.0031
Loa Loa (eye worm) jmjC domain-containing protein 0.0027 0.0048 0.0066
Onchocerca volvulus 0.0052 0.0355 0.0355
Brugia malayi intermediate filament protein 0.0052 0.0355 0.0487
Loa Loa (eye worm) cytochrome P450 family protein 0.0047 0.0291 0.04
Brugia malayi jmjC domain containing protein 0.0164 0.1691 0.2321
Loa Loa (eye worm) intermediate filament protein 0.0052 0.0355 0.0487
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0051 0.0333 0.0657
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.006 0.0442 0.7101
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0056 0.0392 0.6302
Mycobacterium ulcerans aldehyde dehydrogenase 0.0064 0.0498 1
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0028 0.0064 0.0088
Trichomonas vaginalis set domain proteins, putative 0.0474 0.5387 1
Trichomonas vaginalis nuclear lim interactor-interacting factor, putative 0.0026 0.0035 0.0065
Echinococcus multilocularis lysine specific demethylase 5A 0.01 0.0926 0.0926
Mycobacterium ulcerans aldehyde dehydrogenase 0.0064 0.0498 1
Echinococcus multilocularis jumonji domain containing protein 0.0043 0.0245 0.0245
Plasmodium falciparum phd finger protein, putative 0.0031 0.01 0.1602
Plasmodium vivax hypothetical protein, conserved 0.0031 0.01 0.1602
Loa Loa (eye worm) jmjC domain-containing protein 0.0027 0.0048 0.0066
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0038 0.0185 0.2972
Trichomonas vaginalis bromodomain-containing protein, putative 0.0044 0.0253 0.047
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0094 0.0856 0.1689
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0094 0.0856 0.1689
Echinococcus granulosus lamin 0.0052 0.0355 0.07
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0101 0.094 0.1289
Trichomonas vaginalis inositol monophosphatase, putative 0.0039 0.0197 0.0365
Echinococcus granulosus jumonji domain containing protein 0.0043 0.0245 0.0483
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0035 0.0148 0.0331
Entamoeba histolytica histone deacetylase, putative 0.0075 0.0622 0.5641
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0094 0.0856 0.1689
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0039 0.0189 0.035
Giardia lamblia Nuclear LIM interactor-interacting factor 1 0.0026 0.0035 0.0561
Leishmania major sterol 24-c-methyltransferase, putative 0.0397 0.4471 1
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0217 0.2314 0.2314
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0094 0.0856 0.0856
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0038 0.0185 0.0414
Trypanosoma brucei histone deacetylase 1 0.0075 0.0622 0.1392
Trypanosoma cruzi hypothetical protein, conserved 0.0026 0.0035 0.0078
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0027 0.0048 0.0095
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0038 0.0185 0.0414
Loa Loa (eye worm) phosphatidylinositol 3 0.0193 0.2033 0.279
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0039 0.0189 0.035
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0094 0.0856 0.1175
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0039 0.0197 0.0365
Loa Loa (eye worm) hypothetical protein 0.0024 0.002 0.0027
Schistosoma mansoni inositol monophosphatase 0.0039 0.0197 0.0388
Schistosoma mansoni hypothetical protein 0.0166 0.1709 0.337
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.007 0.0565 0.0775
Leishmania major hypothetical protein, conserved 0.0027 0.0048 0.0108
Loa Loa (eye worm) hypothetical protein 0.0051 0.0344 0.0471
Trypanosoma brucei sterol 24-c-methyltransferase, putative 0.0397 0.4471 1
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0044 0.0253 0.4064
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0115 0.1103 0.2048
Echinococcus granulosus lamin dm0 0.0052 0.0355 0.07
Loa Loa (eye worm) hypothetical protein 0.0194 0.204 0.2799
Loa Loa (eye worm) MBCTL1 0.0058 0.0417 0.0572
Entamoeba histolytica acetyltransferase, GNAT family 0.004 0.0209 0.1897
Loa Loa (eye worm) hypothetical protein 0.0075 0.0619 0.085
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.007 0.0565 0.1264
Brugia malayi jmjC domain containing protein 0.0027 0.0048 0.0066
Schistosoma mansoni myelin transcription factor 1 myt1 0.0058 0.0417 0.0822
Plasmodium falciparum histone deacetylase 1 0.0075 0.0622 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0094 0.0856 0.1689
Plasmodium vivax NLI interacting factor-like phosphatase, putative 0.0026 0.0035 0.0561
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.006 0.0442 0.0442
Trichomonas vaginalis ap endonuclease, putative 0.0038 0.0185 0.0343
Brugia malayi Histone deacetylase 1 0.0075 0.0622 0.0854
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0058 0.0417 0.0417
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0038 0.0185 0.2972
Loa Loa (eye worm) hypothetical protein 0.0058 0.0417 0.0572
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0092 0.0823 0.7456
Brugia malayi vesicular acetylcholine transporter unc-17 0.0448 0.5071 0.6958
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0058 0.0417 0.0822
Onchocerca volvulus 0.0633 0.7288 1
Leishmania major lanosterol synthase, putative 0.0143 0.1438 0.3217
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0064 0.0498 0.1114
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0027 0.0048 0.0095
Echinococcus granulosus histone deacetylase 3 0.0075 0.0622 0.1227
Brugia malayi Carboxy-terminal domain RNA polymerase II polypeptide A smallphosphatase 1 0.0026 0.0035 0.0048
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0149 0.1511 0.2979
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0039 0.0197 0.044
Echinococcus multilocularis histone acetyltransferase MYST2 0.0058 0.0417 0.0417
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0217 0.2314 0.4563
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0051 0.0338 0.3067
Trypanosoma brucei Sterol methyltransferase, putative 0.0397 0.4471 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.002 0.0027
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0112 0.1063 0.9631
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0079 0.0673 0.1249
Schistosoma mansoni jumonji/arid domain-containing protein 0.01 0.0926 0.1825
Trichomonas vaginalis histone deacetylase, putative 0.0075 0.0622 0.1155
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.007 0.0565 0.0775
Trichomonas vaginalis histone deacetylase, putative 0.0075 0.0622 0.1155
Brugia malayi Pre-SET motif family protein 0.006 0.0442 0.0606
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0039 0.0189 0.0422
Schistosoma mansoni hypothetical protein 0.0025 0.0031 0.0061
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0044 0.0253 0.047
Trypanosoma brucei sterol 24-c-methyltransferase, putative 0.0207 0.2202 0.4925
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.006 0.0442 0.0872
Onchocerca volvulus 0.0051 0.0333 0.0325
Loa Loa (eye worm) hypothetical protein 0.0041 0.0213 0.0293
Echinococcus granulosus geminin 0.0166 0.1709 0.337
Trichomonas vaginalis nuclear lim interactor-interacting factor, putative 0.0026 0.0035 0.0065
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.006 0.0442 0.0872
Trypanosoma cruzi lanosterol synthase, putative 0.0166 0.1709 0.3823
Schistosoma mansoni aldehyde dehydrogenase 0.0064 0.0498 0.0982
Echinococcus multilocularis musashi 0.0052 0.0355 0.0355
Loa Loa (eye worm) hypothetical protein 0.0633 0.7288 1
Echinococcus granulosus peregrin 0.0035 0.0143 0.0283
Entamoeba histolytica NLI interacting factor-like phosphatase domain-containing protein 0.0026 0.0035 0.0317
Plasmodium falciparum histone acetyltransferase GCN5 0.004 0.0209 0.3363
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0064 0.0498 0.0498
Brugia malayi PHD-finger family protein 0.0031 0.01 0.0137

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) = -8 % Inhibition of PTH-stimulated osteoclast-like cell formation at concentration 2 uM ChEMBL. No reference
Inhibition (functional) = 27 % Inhibition of PTH-stimulated osteoclast-like cell formation at concentration 5 uM ChEMBL. No reference
Inhibition (functional) = 33 % Inhibition of PTH-stimulated bone resorption at concentration of 2 microM ChEMBL. No reference
Inhibition (functional) = 37 % Inhibition of PTH-stimulated osteoclast-like cell formation at concentration 10 uM ChEMBL. No reference
Inhibition (functional) = 40 % Inhibition of PTH-stimulated bone resorption at concentration of 5 microM ChEMBL. No reference
Inhibition (functional) = 47 % Inhibition of PTH-stimulated bone resorption at concentration of 10 microM 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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