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