Detailed information for compound 25162

Basic information

Technical information
  • TDR Targets ID: 25162
  • Name: 3-[(1-benzylindol-3-yl)methyl]-7-chloro-1-met hyl-5-phenyl-3H-1,4-benzodiazepin-2-one
  • MW: 504.021 | Formula: C32H26ClN3O
  • H donors: 0 H acceptors: 1 LogP: 6.89 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 2
  • SMILES: Clc1ccc2c(c1)C(=NC(C(=O)N2C)Cc1cn(c2c1cccc2)Cc1ccccc1)c1ccccc1
  • InChi: 1S/C32H26ClN3O/c1-35-29-17-16-25(33)19-27(29)31(23-12-6-3-7-13-23)34-28(32(35)37)18-24-21-36(20-22-10-4-2-5-11-22)30-15-9-8-14-26(24)30/h2-17,19,21,28H,18,20H2,1H3
  • InChiKey: LPEQPASJAXUBKT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-[(1-benzyl-3-indolyl)methyl]-7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one
  • 7-chloro-1-methyl-5-phenyl-3-[[1-(phenylmethyl)indol-3-yl]methyl]-3H-1,4-benzodiazepin-2-one
  • 7-chloro-1-methyl-5-phenyl-3-[[1-(phenylmethyl)-3-indolyl]methyl]-3H-1,4-benzodiazepin-2-one
  • 3-[[1-(benzyl)indol-3-yl]methyl]-7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one

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
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Echinococcus granulosus carbonyl reductase 1 0.0171 0.4063 0.5237
Loa Loa (eye worm) oxidoreductase 0.0171 0.4063 0.4063
Trypanosoma cruzi hypothetical protein, conserved 0.0171 0.4063 0.5
Schistosoma mansoni steroid dehydrogenase 0.0171 0.4063 0.7751
Trypanosoma cruzi hypothetical protein, conserved 0.0171 0.4063 0.5
Trypanosoma brucei short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Entamoeba histolytica hypothetical protein, conserved 0.0171 0.4063 0.5
Toxoplasma gondii 3-ketoacyl-CoA reductase, putative 0.0171 0.4063 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.5
Loa Loa (eye worm) hypothetical protein 0.0116 0.156 0.156
Mycobacterium tuberculosis Probable oxidoreductase 0.0171 0.4063 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Plasmodium vivax hypothetical protein, conserved 0.0171 0.4063 0.5
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 13 homolog 0.0171 0.4063 0.5
Mycobacterium ulcerans short-chain dehydrogenase 0.0171 0.4063 0.5
Echinococcus granulosus carbonyl reductase 1 0.0171 0.4063 0.5237
Onchocerca volvulus 0.0171 0.4063 0.5
Schistosoma mansoni steroid dehydrogenase 0.0171 0.4063 0.7751
Mycobacterium tuberculosis Probable short-chain dehydrogenase/reductase 0.0171 0.4063 0.5
Echinococcus granulosus retinol dehydrogenase 11 0.0171 0.4063 0.5237
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0171 0.4063 0.5
Echinococcus granulosus Dehydrogenase:reductase SDR family 0.0171 0.4063 0.5237
Toxoplasma gondii carbonyl reductase 1, putative 0.0171 0.4063 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Onchocerca volvulus 0.0171 0.4063 0.5
Mycobacterium tuberculosis Probable dehydrogenase/reductase 0.0171 0.4063 0.5
Mycobacterium ulcerans oxidoreductase 0.0171 0.4063 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 13 homolog 0.0171 0.4063 0.5
Mycobacterium ulcerans short-chain dehydrogenase 0.0171 0.4063 0.5
Mycobacterium ulcerans short-chain dehydrogenase 0.0171 0.4063 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Mycobacterium ulcerans ketoacyl reductase 0.0171 0.4063 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0171 0.4063 0.5237
Loa Loa (eye worm) oxidoreductase 0.0171 0.4063 0.4063
Loa Loa (eye worm) integrin beta-2 0.0303 1 1
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0171 0.4063 0.5237
Schistosoma mansoni carbonyl reductase 0.0171 0.4063 0.7751
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Schistosoma mansoni carbonyl reductase 0.0171 0.4063 0.7751
Mycobacterium tuberculosis Possible short-chain dehydrogenase EphD 0.0171 0.4063 0.5
Trichomonas vaginalis hydroxyacyl dehydrogenase, putative 0.0171 0.4063 0.5
Echinococcus granulosus integrin beta 2 0.0224 0.6452 1
Echinococcus multilocularis conserved hypothetical protein 0.0171 0.4063 0.5237
Trypanosoma cruzi short chain dehydrogenase, putative 0.0171 0.4063 0.5
Echinococcus granulosus hypothetical protein 0.0171 0.4063 0.5237
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0171 0.4063 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Mycobacterium ulcerans short-chain type oxidoreductase 0.0171 0.4063 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Echinococcus multilocularis transient receptor potential cation channel 0.0171 0.4063 0.5237
Loa Loa (eye worm) hypothetical protein 0.0112 0.1368 0.1368
Onchocerca volvulus 0.0171 0.4063 0.5
Leishmania major short chain dehydrogenase/reductase, putative 0.0171 0.4063 0.5
Leishmania major short chain dehydrogenase-like protein 0.0171 0.4063 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.5
Brugia malayi D-beta-hydroxybutyrate dehydrogenase, mitochondrial precursor 0.0171 0.4063 0.3122
Schistosoma mansoni short-chain dehydrogenase/reductase 0.0171 0.4063 0.7751
Trypanosoma brucei 3-ketoacyl-CoA reductase, putative 0.0171 0.4063 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0171 0.4063 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0171 0.4063 0.5
Trichomonas vaginalis short-chain dehydrogenases/reductase, putative 0.0171 0.4063 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0171 0.4063 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Plasmodium vivax steroid dehydrogenase, putative 0.0171 0.4063 0.5
Loa Loa (eye worm) hypothetical protein 0.0171 0.4063 0.4063
Echinococcus multilocularis retinol dehydrogenase 11 0.0171 0.4063 0.5237
Trypanosoma brucei short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Mycobacterium tuberculosis Possible ketoacyl reductase 0.0171 0.4063 0.5
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Loa Loa (eye worm) dehydrogenase 0.0171 0.4063 0.4063
Schistosoma mansoni steroid dehydrogenase 0.0171 0.4063 0.7751
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0171 0.4063 0.5
Mycobacterium leprae PROBABLE SHORT CHAIN ALCOHOL DEHYDROGENASE/REDUCTASE 0.0171 0.4063 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0171 0.4063 0.5
Entamoeba histolytica short chain dehydrogenase family protein 0.0171 0.4063 0.5
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0171 0.4063 0.3122
Leishmania major hypothetical protein, conserved 0.0171 0.4063 0.5
Mycobacterium leprae Possible short-chain dehydrogenase EphD 0.0171 0.4063 0.5
Leishmania major short chain dehydrogenase, putative 0.0171 0.4063 0.5
Mycobacterium tuberculosis Possible fatty acyl-CoA reductase 0.0171 0.4063 0.5
Echinococcus granulosus retinol dehydrogenase 11 0.0171 0.4063 0.5237
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0171 0.4063 0.5
Trypanosoma cruzi quinonoid dihydropteridine reductase, putative 0.0171 0.4063 0.5
Mycobacterium ulcerans oxidoreductase 0.0171 0.4063 0.5
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0171 0.4063 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Toxoplasma gondii oxidoreductase, putative 0.0171 0.4063 0.5
Brugia malayi hypothetical protein 0.0171 0.4063 0.3122
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Schistosoma mansoni integrin beta subunit 0.0178 0.4373 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Schistosoma mansoni steroid dehydrogenase 0.0171 0.4063 0.7751
Mycobacterium tuberculosis Probable short-chain type oxidoreductase 0.0171 0.4063 0.5
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Mycobacterium tuberculosis Probable short chain alcohol dehydrogenase/reductase 0.0171 0.4063 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Entamoeba histolytica oxidoreductase, short chain dehydrogenase/reductase family 0.0171 0.4063 0.5
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Entamoeba histolytica hypothetical protein, conserved 0.0171 0.4063 0.5
Schistosoma mansoni steroid dehydrogenase 0.0171 0.4063 0.7751
Plasmodium falciparum steroid dehydrogenase, putative 0.0171 0.4063 0.5
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Echinococcus multilocularis carbonyl reductase 1 0.0171 0.4063 0.5237
Trypanosoma brucei beta-D-hydroxybutyrate dehydrogenase 0.0171 0.4063 0.5
Giardia lamblia Reductase, putative 0.0171 0.4063 0.5
Brugia malayi Integrin alpha pat-2 precursor 0.0148 0.2996 0.1886
Trichomonas vaginalis estradiol 17 beta-dehydrogenase, putative 0.0171 0.4063 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0171 0.4063 0.5
Toxoplasma gondii oxidoreductase, putative 0.0171 0.4063 0.5
Echinococcus multilocularis 3 ketodihydrosphingosine reductase 0.0171 0.4063 0.5237
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Toxoplasma gondii 2,4-dienoyl CoA reductase 2, peroxisomal family protein 0.0171 0.4063 0.5
Loa Loa (eye worm) hypothetical protein 0.0171 0.4063 0.4063
Wolbachia endosymbiont of Brugia malayi Short-chain alcohol dehydrogenase family enzyme 0.0171 0.4063 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Trypanosoma brucei 3-keto-dihydrosphingosine reductase 0.0171 0.4063 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Brugia malayi dehydrogenases, short chain protein 2 0.0171 0.4063 0.3122
Loa Loa (eye worm) hypothetical protein 0.0171 0.4063 0.4063
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0171 0.4063 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0171 0.4063 0.5
Echinococcus granulosus carbonyl reductase 1 0.0171 0.4063 0.5237
Loa Loa (eye worm) hypothetical protein 0.0171 0.4063 0.4063
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Mycobacterium tuberculosis Probable dehydrogenase 0.0171 0.4063 0.5
Mycobacterium ulcerans carveol-like dehydrogenase 0.0171 0.4063 0.5
Leishmania major oxidoreductase-like protein 0.0171 0.4063 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Giardia lamblia Hypothetical protein 0.0171 0.4063 0.5
Onchocerca volvulus 0.0171 0.4063 0.5
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Echinococcus multilocularis retinol dehydrogenase 11 0.0171 0.4063 0.5237
Leishmania major hypothetical protein, conserved 0.0171 0.4063 0.5
Schistosoma mansoni retinal dehydrogenase 0.0171 0.4063 0.7751
Leishmania major short chain dehydrogenase/reductase, putative 0.0171 0.4063 0.5
Entamoeba histolytica 3-ketodihydrosphingosine reductase protein, putative 0.0171 0.4063 0.5
Loa Loa (eye worm) oxidoreductase 0.0171 0.4063 0.4063
Echinococcus multilocularis integrin beta 2 0.0224 0.6452 1
Leishmania major quinonoid dihydropteridine reductase 0.0171 0.4063 0.5
Echinococcus granulosus epidermal retinal dehydrogenase 2 0.0171 0.4063 0.5237
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Brugia malayi dehydrogenases, short chain protein 9 0.0171 0.4063 0.3122
Echinococcus multilocularis steroid dehydrogenase 0.0171 0.4063 0.5237
Mycobacterium tuberculosis Possible iron-regulated short-chain dehydrogenase/reductase 0.0171 0.4063 0.5
Echinococcus granulosus carbonyl reductase 1 0.0171 0.4063 0.5237
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0171 0.4063 0.5
Trypanosoma cruzi short chain dehydrogenase, putative 0.0171 0.4063 0.5
Mycobacterium ulcerans dehydrogenase/decarboxylase protein 0.0171 0.4063 0.5
Loa Loa (eye worm) oxidoreductase 0.0171 0.4063 0.4063
Schistosoma mansoni steroid dehydrogenase 0.0171 0.4063 0.7751
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Trichomonas vaginalis steroid dehydrogenase, putative 0.0171 0.4063 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0171 0.4063 0.5237
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Echinococcus multilocularis epidermal retinal dehydrogenase 2 0.0171 0.4063 0.5237
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Mycobacterium tuberculosis Possible oxidoreductase 0.0171 0.4063 0.5
Mycobacterium ulcerans 3-alpha-hydroxysteroid dehydrogenase 0.0171 0.4063 0.5
Mycobacterium ulcerans short-chain membrane-associated dehydrogenase 0.0171 0.4063 0.5
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0171 0.4063 0.5
Plasmodium falciparum oxidoreductase, short-chain dehydrogenase family, putative 0.0171 0.4063 0.5
Loa Loa (eye worm) oxidoreductase 0.0171 0.4063 0.4063
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Loa Loa (eye worm) oxidoreductase 0.0171 0.4063 0.4063
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0171 0.4063 0.5
Loa Loa (eye worm) integrin alpha pat-2 0.0228 0.6614 0.6614
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Mycobacterium tuberculosis Probable oxidoreductase 0.0171 0.4063 0.5
Mycobacterium ulcerans ketoacyl reductase 0.0171 0.4063 0.5
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Echinococcus multilocularis steroid dehydrogenase 0.0171 0.4063 0.5237
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.5
Loa Loa (eye worm) short chain dehydrogenase/reductase family oxidoreductase 0.0171 0.4063 0.4063
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Schistosoma mansoni steroid dehydrogenase 0.0171 0.4063 0.7751
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0171 0.4063 0.5
Echinococcus granulosus hypothetical protein 0.0171 0.4063 0.5237
Entamoeba histolytica hypothetical protein 0.0171 0.4063 0.5
Onchocerca volvulus 0.0171 0.4063 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Mycobacterium ulcerans ketoacyl reductase 0.0171 0.4063 0.5
Mycobacterium tuberculosis Possible multi-functional enzyme with acyl-CoA-reductase activity AcrA1 0.0171 0.4063 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Trypanosoma brucei short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Leishmania major hypothetical protein, conserved 0.0171 0.4063 0.5
Onchocerca volvulus 0.0171 0.4063 0.5
Trypanosoma brucei oxidoreductase-like protein 0.0171 0.4063 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Trypanosoma brucei short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Echinococcus multilocularis retinol dehydrogenase 13 0.0171 0.4063 0.5237
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0171 0.4063 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0171 0.4063 0.5
Schistosoma mansoni oxidoreductase short chain dehydrogenase/reductase family 0.0171 0.4063 0.7751
Leishmania major quinonoid dihydropteridine reductase 0.0171 0.4063 0.5
Schistosoma mansoni carbonyl reductase 0.0171 0.4063 0.7751
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0171 0.4063 0.7751
Loa Loa (eye worm) oxidoreductase 0.0171 0.4063 0.4063
Onchocerca volvulus 0.0171 0.4063 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0171 0.4063 0.5237
Brugia malayi Retinol dehydrogenase 12 0.0171 0.4063 0.3122
Mycobacterium tuberculosis Probable shortchain dehydrogenase 0.0171 0.4063 0.5
Loa Loa (eye worm) hypothetical protein 0.0171 0.4063 0.4063
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0171 0.4063 0.5
Leishmania major dehydrogenase-like protein 0.0171 0.4063 0.5
Onchocerca volvulus 0.0171 0.4063 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0171 0.4063 0.5
Giardia lamblia Oxidoreductase, short chain dehydrogenase/reductase family 0.0171 0.4063 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0171 0.4063 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Trypanosoma brucei short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.5
Loa Loa (eye worm) oxidoreductase 0.0171 0.4063 0.4063
Mycobacterium leprae ROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCTASE 0.0171 0.4063 0.5
Mycobacterium tuberculosis Probable dehydrogenase/reductase 0.0171 0.4063 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.5
Schistosoma mansoni steroid dehydrogenase 0.0171 0.4063 0.7751
Echinococcus granulosus 3 ketodihydrosphingosine reductase 0.0171 0.4063 0.5237
Mycobacterium ulcerans short-chain dehydrogenase 0.0171 0.4063 0.5
Onchocerca volvulus 0.0171 0.4063 0.5
Loa Loa (eye worm) hypothetical protein 0.0171 0.4063 0.4063
Leishmania major hypothetical protein, conserved 0.0171 0.4063 0.5
Mycobacterium tuberculosis Decaprenylphosphoryl-D-2-keto erythro pentose reductase 0.0171 0.4063 0.5
Entamoeba histolytica short chain dehydrogenase family protein 0.0171 0.4063 0.5
Onchocerca volvulus 0.0171 0.4063 0.5
Echinococcus granulosus WW domain containing oxidoreductase 0.0171 0.4063 0.5237
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Onchocerca volvulus 0.0171 0.4063 0.5
Loa Loa (eye worm) hypothetical protein 0.0171 0.4063 0.4063
Mycobacterium leprae Probable short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Mycobacterium leprae Probable oxidoreductase 0.0171 0.4063 0.5
Loa Loa (eye worm) hypothetical protein 0.0171 0.4063 0.4063
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Mycobacterium leprae Probable short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0171 0.4063 0.5
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Brugia malayi Dehydrogenases, short chain protein 30 0.0171 0.4063 0.3122
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0171 0.4063 0.5237
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Onchocerca volvulus 0.0171 0.4063 0.5
Echinococcus granulosus oxidoreductase 0.0171 0.4063 0.5237
Leishmania major short chain dehydrogenase, putative 0.0171 0.4063 0.5
Loa Loa (eye worm) hypothetical protein 0.0171 0.4063 0.4063
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0171 0.4063 0.5
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0171 0.4063 0.5
Mycobacterium tuberculosis Possible oxidoreductase 0.0171 0.4063 0.5
Brugia malayi oxidoreductase 0.0171 0.4063 0.3122
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Leishmania major 3-keto-dihydrosphingosine reductase 0.0171 0.4063 0.5
Schistosoma mansoni steroid dehydrogenase 0.0171 0.4063 0.7751
Echinococcus granulosus steroid dehydrogenase 0.0171 0.4063 0.5237
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Loa Loa (eye worm) oxidoreductase 0.0171 0.4063 0.4063
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0171 0.4063 0.5
Brugia malayi Dehydrogenases, short chain protein 2 0.0171 0.4063 0.3122
Toxoplasma gondii sterol carrier protein-2 HAD-2SCP-2 0.0171 0.4063 0.5
Echinococcus multilocularis Dehydrogenase:reductase SDR family 0.0171 0.4063 0.5237
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Giardia lamblia Short-chain dehydrogenase, putative 0.0171 0.4063 0.5
Trypanosoma brucei beta-ketoacyl-ACP reductase 3, putative 0.0171 0.4063 0.5
Loa Loa (eye worm) dehydrogenase 0.0171 0.4063 0.4063
Brugia malayi hypothetical protein 0.0171 0.4063 0.3122
Mycobacterium ulcerans dehydrogenase 0.0171 0.4063 0.5
Onchocerca volvulus 0.0171 0.4063 0.5
Mycobacterium ulcerans dehydrogenase/reductase 0.0171 0.4063 0.5
Loa Loa (eye worm) hypothetical protein 0.0171 0.4063 0.4063
Leishmania major hypothetical protein, conserved 0.0171 0.4063 0.5
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 1 homolog 0.0171 0.4063 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0171 0.4063 0.5
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0171 0.4063 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0171 0.4063 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Schistosoma mansoni steroid dehydrogenase 0.0171 0.4063 0.7751
Mycobacterium tuberculosis Probable oxidoreductase 0.0171 0.4063 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Schistosoma mansoni 3-keto-dihydrosphingosine reductase 0.0171 0.4063 0.7751
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Trypanosoma brucei beta-ketoacyl-ACP reductase 2 0.0171 0.4063 0.5
Leishmania major pteridine reductase 1 0.0171 0.4063 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0171 0.4063 0.3122
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Echinococcus multilocularis oxidoreductase 0.0171 0.4063 0.5237
Brugia malayi Hypothetical oxidoreductase F56D1.5 0.0171 0.4063 0.3122
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0171 0.4063 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0171 0.4063 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0171 0.4063 0.5
Schistosoma mansoni short chain dehydrogenase 0.0171 0.4063 0.7751
Mycobacterium ulcerans short chain dehydrogenase 0.0171 0.4063 0.5
Loa Loa (eye worm) hypothetical protein 0.0171 0.4063 0.4063
Echinococcus multilocularis estradiol 17 beta dehydrogenase 12 0.0171 0.4063 0.5237
Onchocerca volvulus Sepiapterin reductase homolog 0.0171 0.4063 0.5

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) > 100 uM Half-maximal inhibition of [125I]-CCK-33 binding to guinea pig brain(cortex) cholecystokinin receptor ChEMBL. 2885419
IC50 (functional) > 100 uM Half-maximal inhibition of binding of [125I]-gastrin to guinea pig gastric glands ChEMBL. 2885419
IC50 (binding) ~ 150 uM Half-maximal inhibition of [125I]-CCK-33 binding to rat pancreas cholecystokinin receptor ChEMBL. 2885419

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

1 literature reference was collected for this gene.

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