Detailed information for compound 1565583

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 324.758 | Formula: C19H13ClO3
  • H donors: 2 H acceptors: 3 LogP: 4.81 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Oc1ccc(c(c1)Cl)c1ccc(cc1)C(=O)c1cccc(c1)O
  • InChi: 1S/C19H13ClO3/c20-18-11-16(22)8-9-17(18)12-4-6-13(7-5-12)19(23)14-2-1-3-15(21)10-14/h1-11,21-22H
  • InChiKey: WOSDRBVPQTZWNZ-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens hydroxysteroid (17-beta) dehydrogenase 2 Starlite/ChEMBL References
Homo sapiens hydroxysteroid (17-beta) dehydrogenase 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus multilocularis Dehydrogenase:reductase SDR family hydroxysteroid (17-beta) dehydrogenase 2 387 aa 359 aa 24.8 %
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein hydroxysteroid (17-beta) dehydrogenase 1 328 aa 265 aa 27.2 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Trypanosoma cruzi short chain dehydrogenase, putative 0.0009 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0009 1 0.5
Echinococcus granulosus WW domain containing oxidoreductase 0.0009 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 1 0.5
Mycobacterium ulcerans short-chain dehydrogenase 0.0009 1 0.5
Schistosoma mansoni short-chain dehydrogenase/reductase 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0009 1 0.5
Leishmania major hypothetical protein, conserved 0.0009 1 0.5
Giardia lamblia Short-chain dehydrogenase, putative 0.0009 1 0.5
Mycobacterium ulcerans dehydrogenase 0.0009 1 0.5
Mycobacterium ulcerans short-chain dehydrogenase 0.0009 1 0.5
Mycobacterium tuberculosis Probable shortchain dehydrogenase 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Plasmodium falciparum oxidoreductase, short-chain dehydrogenase family, putative 0.0009 1 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0009 1 0.5
Loa Loa (eye worm) oxidoreductase 0.0009 1 0.5
Leishmania major short chain dehydrogenase, putative 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0009 1 0.5
Mycobacterium tuberculosis Probable short chain alcohol dehydrogenase/reductase 0.0009 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0009 1 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0009 1 0.5
Mycobacterium tuberculosis Possible fatty acyl-CoA reductase 0.0009 1 0.5
Trypanosoma brucei short-chain dehydrogenase, putative 0.0009 1 0.5
Mycobacterium ulcerans short-chain dehydrogenase 0.0009 1 0.5
Mycobacterium tuberculosis Possible multi-functional enzyme with acyl-CoA-reductase activity AcrA1 0.0009 1 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Brugia malayi Dehydrogenases, short chain protein 2 0.0009 1 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Trichomonas vaginalis estradiol 17 beta-dehydrogenase, putative 0.0009 1 0.5
Echinococcus multilocularis oxidoreductase 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Plasmodium vivax hypothetical protein, conserved 0.0009 1 0.5
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0009 1 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0009 1 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0009 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 1 0.5
Echinococcus granulosus hypothetical protein 0.0009 1 0.5
Mycobacterium ulcerans short-chain type oxidoreductase 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0009 1 0.5
Giardia lamblia Reductase, putative 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0009 1 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0009 1 0.5
Mycobacterium tuberculosis Possible oxidoreductase 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0009 1 0.5
Toxoplasma gondii 2,4-dienoyl CoA reductase 2, peroxisomal family protein 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Entamoeba histolytica 3-ketodihydrosphingosine reductase protein, putative 0.0009 1 1
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Echinococcus multilocularis retinol dehydrogenase 11 0.0009 1 0.5
Loa Loa (eye worm) short chain dehydrogenase/reductase family oxidoreductase 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0009 1 0.5
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0009 1 1
Mycobacterium tuberculosis Decaprenylphosphoryl-D-2-keto erythro pentose reductase 0.0009 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0009 1 0.5
Entamoeba histolytica oxidoreductase, short chain dehydrogenase/reductase family 0.0009 1 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0009 1 0.5
Schistosoma mansoni 3-keto-dihydrosphingosine reductase 0.0009 1 0.5
Trypanosoma cruzi short chain dehydrogenase, putative 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Onchocerca volvulus Sepiapterin reductase homolog 0.0009 1 0.5
Toxoplasma gondii 3-ketoacyl-CoA reductase, putative 0.0009 1 0.5
Echinococcus multilocularis conserved hypothetical protein 0.0009 1 0.5
Loa Loa (eye worm) oxidoreductase 0.0009 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 1 0.5
Mycobacterium tuberculosis Possible ketoacyl reductase 0.0009 1 0.5
Mycobacterium tuberculosis Probable dehydrogenase 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 1 0.5
Echinococcus granulosus hypothetical protein 0.0009 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 1 0.5
Toxoplasma gondii oxidoreductase, putative 0.0009 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0009 1 0.5
Mycobacterium leprae Possible short-chain dehydrogenase EphD 0.0009 1 0.5
Echinococcus granulosus 3 ketodihydrosphingosine reductase 0.0009 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 1 0.5
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Leishmania major short chain dehydrogenase-like protein 0.0009 1 0.5
Trypanosoma brucei oxidoreductase-like protein 0.0009 1 0.5
Echinococcus granulosus carbonyl reductase 1 0.0009 1 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0009 1 0.5
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0009 1 1
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0009 1 0.5
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0009 1 0.5
Mycobacterium ulcerans 3-alpha-hydroxysteroid dehydrogenase 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0009 1 0.5
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Leishmania major hypothetical protein, conserved 0.0009 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0009 1 0.5
Schistosoma mansoni carbonyl reductase 0.0009 1 0.5
Entamoeba histolytica hypothetical protein, conserved 0.0009 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0009 1 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0009 1 0.5
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0009 1 0.5
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0009 1 0.5
Trypanosoma brucei beta-ketoacyl-ACP reductase 3, putative 0.0009 1 0.5
Mycobacterium tuberculosis Probable short-chain dehydrogenase/reductase 0.0009 1 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0009 1 0.5
Trypanosoma brucei beta-D-hydroxybutyrate dehydrogenase 0.0009 1 0.5
Mycobacterium ulcerans ketoacyl reductase 0.0009 1 0.5
Echinococcus multilocularis Dehydrogenase:reductase SDR family 0.0009 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0009 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 1 0.5
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 13 homolog 0.0009 1 0.5
Leishmania major 3-keto-dihydrosphingosine reductase 0.0009 1 0.5
Echinococcus multilocularis steroid dehydrogenase 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Mycobacterium tuberculosis Possible iron-regulated short-chain dehydrogenase/reductase 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Brugia malayi dehydrogenases, short chain protein 9 0.0009 1 0.5
Trypanosoma cruzi quinonoid dihydropteridine reductase, putative 0.0009 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Echinococcus multilocularis epidermal retinal dehydrogenase 2 0.0009 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0009 1 0.5
Plasmodium vivax steroid dehydrogenase, putative 0.0009 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0009 1 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0009 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 1 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0009 1 0.5
Loa Loa (eye worm) oxidoreductase 0.0009 1 0.5
Trypanosoma brucei beta-ketoacyl-ACP reductase 2 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Mycobacterium tuberculosis Probable dehydrogenase/reductase 0.0009 1 0.5
Loa Loa (eye worm) oxidoreductase 0.0009 1 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0009 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Toxoplasma gondii sterol carrier protein-2 HAD-2SCP-2 0.0009 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0009 1 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0009 1 0.5
Mycobacterium ulcerans oxidoreductase 0.0009 1 0.5
Leishmania major hypothetical protein, conserved 0.0009 1 0.5
Trypanosoma brucei 3-keto-dihydrosphingosine reductase 0.0009 1 0.5
Schistosoma mansoni carbonyl reductase 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0009 1 0.5
Leishmania major hypothetical protein, conserved 0.0009 1 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0009 1 0.5
Brugia malayi Dehydrogenases, short chain protein 30 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Echinococcus multilocularis 3 ketodihydrosphingosine reductase 0.0009 1 0.5
Wolbachia endosymbiont of Brugia malayi Short-chain alcohol dehydrogenase family enzyme 0.0009 1 0.5
Mycobacterium leprae Probable short-chain type dehydrogenase/reductase 0.0009 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Brugia malayi D-beta-hydroxybutyrate dehydrogenase, mitochondrial precursor 0.0009 1 0.5
Leishmania major dehydrogenase-like protein 0.0009 1 0.5
Leishmania major hypothetical protein, conserved 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Mycobacterium leprae Probable short-chain type dehydrogenase/reductase 0.0009 1 0.5
Mycobacterium ulcerans dehydrogenase/decarboxylase protein 0.0009 1 0.5
Loa Loa (eye worm) oxidoreductase 0.0009 1 0.5
Mycobacterium ulcerans carveol-like dehydrogenase 0.0009 1 0.5
Brugia malayi oxidoreductase 0.0009 1 0.5
Entamoeba histolytica hypothetical protein, conserved 0.0009 1 1
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Trypanosoma brucei 3-ketoacyl-CoA reductase, putative 0.0009 1 0.5
Entamoeba histolytica short chain dehydrogenase family protein 0.0009 1 1
Loa Loa (eye worm) oxidoreductase 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Schistosoma mansoni carbonyl reductase 0.0009 1 0.5
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0009 1 0.5
Trichomonas vaginalis steroid dehydrogenase, putative 0.0009 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0009 1 0.5
Trypanosoma brucei short-chain dehydrogenase, putative 0.0009 1 0.5
Plasmodium falciparum steroid dehydrogenase, putative 0.0009 1 0.5
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0009 1 0.5
Echinococcus granulosus carbonyl reductase 1 0.0009 1 0.5
Echinococcus granulosus retinol dehydrogenase 11 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Trichomonas vaginalis short-chain dehydrogenases/reductase, putative 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Mycobacterium tuberculosis Probable short-chain type oxidoreductase 0.0009 1 0.5
Trypanosoma brucei short-chain dehydrogenase, putative 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Brugia malayi Retinol dehydrogenase 12 0.0009 1 0.5
Mycobacterium ulcerans short-chain dehydrogenase 0.0009 1 0.5
Leishmania major short chain dehydrogenase/reductase, putative 0.0009 1 0.5
Loa Loa (eye worm) oxidoreductase 0.0009 1 0.5
Giardia lamblia Oxidoreductase, short chain dehydrogenase/reductase family 0.0009 1 0.5
Brugia malayi Hypothetical oxidoreductase F56D1.5 0.0009 1 0.5
Mycobacterium leprae ROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCTASE 0.0009 1 0.5
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0009 1 0.5
Leishmania major oxidoreductase-like protein 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Mycobacterium leprae PROBABLE SHORT CHAIN ALCOHOL DEHYDROGENASE/REDUCTASE 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Schistosoma mansoni retinal dehydrogenase 0.0009 1 0.5
Echinococcus multilocularis retinol dehydrogenase 13 0.0009 1 0.5
Echinococcus granulosus retinol dehydrogenase 11 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0009 1 0.5
Mycobacterium ulcerans ketoacyl reductase 0.0009 1 0.5
Brugia malayi hypothetical protein 0.0009 1 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0009 1 0.5
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 13 homolog 0.0009 1 0.5
Echinococcus multilocularis transient receptor potential cation channel 0.0009 1 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0009 1 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0009 1 0.5
Loa Loa (eye worm) dehydrogenase 0.0009 1 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Trypanosoma brucei short-chain dehydrogenase, putative 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 1 homolog 0.0009 1 0.5
Echinococcus granulosus epidermal retinal dehydrogenase 2 0.0009 1 0.5
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0009 1 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0009 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0009 1 0.5
Echinococcus granulosus steroid dehydrogenase 0.0009 1 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0009 1 0.5
Toxoplasma gondii carbonyl reductase 1, putative 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Loa Loa (eye worm) dehydrogenase 0.0009 1 0.5
Echinococcus granulosus carbonyl reductase 1 0.0009 1 0.5
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0009 1 1
Mycobacterium leprae Probable oxidoreductase 0.0009 1 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0009 1 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0009 1 0.5
Brugia malayi hypothetical protein 0.0009 1 0.5
Brugia malayi dehydrogenases, short chain protein 2 0.0009 1 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0009 1 0.5
Mycobacterium ulcerans short-chain membrane-associated dehydrogenase 0.0009 1 0.5
Echinococcus multilocularis retinol dehydrogenase 11 0.0009 1 0.5
Mycobacterium tuberculosis Possible oxidoreductase 0.0009 1 0.5
Entamoeba histolytica hypothetical protein 0.0009 1 1
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0009 1 0.5
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Giardia lamblia Hypothetical protein 0.0009 1 0.5
Echinococcus granulosus oxidoreductase 0.0009 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 1 0.5
Loa Loa (eye worm) oxidoreductase 0.0009 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0009 1 0.5
Mycobacterium ulcerans ketoacyl reductase 0.0009 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0009 1 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0009 1 0.5
Echinococcus granulosus carbonyl reductase 1 0.0009 1 0.5
Leishmania major pteridine reductase 1 0.0009 1 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0009 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0009 1 0.5
Echinococcus multilocularis steroid dehydrogenase 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0009 1 0.5
Echinococcus granulosus Dehydrogenase:reductase SDR family 0.0009 1 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0009 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0009 1 0.5
Mycobacterium ulcerans dehydrogenase/reductase 0.0009 1 0.5
Trichomonas vaginalis hydroxyacyl dehydrogenase, putative 0.0009 1 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0009 1 0.5
Loa Loa (eye worm) oxidoreductase 0.0009 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0009 1 0.5
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0009 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0009 1 0.5
Trypanosoma brucei short-chain dehydrogenase, putative 0.0009 1 0.5
Mycobacterium tuberculosis Possible short-chain dehydrogenase EphD 0.0009 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0009 1 0.5
Entamoeba histolytica short chain dehydrogenase family protein 0.0009 1 1
Mycobacterium ulcerans oxidoreductase 0.0009 1 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0009 1 0.5
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0009 1 0.5
Toxoplasma gondii oxidoreductase, putative 0.0009 1 0.5
Echinococcus multilocularis estradiol 17 beta dehydrogenase 12 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Mycobacterium tuberculosis Probable dehydrogenase/reductase 0.0009 1 0.5
Leishmania major short chain dehydrogenase, putative 0.0009 1 0.5
Onchocerca volvulus 0.0009 1 0.5
Leishmania major short chain dehydrogenase/reductase, putative 0.0009 1 0.5
Schistosoma mansoni oxidoreductase short chain dehydrogenase/reductase family 0.0009 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0009 1 0.5

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 176 nM Inhibition of human microsomal 17beta-HSD2 in cell-free system using [2,4,6,7-3H]E2 as substrate after 20 mins by radioflow detector ChEMBL. 21945251
IC50 (binding) = 1764 nM Inhibition of human cytosolic 17beta-HSD1 in cell-free system using [2,4,6,7-3H]E1 as substrate after 10 mins by radioflow detector ChEMBL. 21945251
Inhibition (binding) = 43 % Inhibition of human cytosolic 17beta-HSD1 using [2,4,6,7-3H]E1 as substrate at 1 uM after 10 mins by radioflow detector ChEMBL. 21945251
Inhibition (binding) = 80 % Inhibition of human microsomal 17beta-HSD2 using [2,4,6,7-3H]E2 as substrate at 1 uM after 20 mins by radioflow detector ChEMBL. 21945251

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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