Detailed information for compound 951974

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 800.825 | Formula: C41H43F3N8O6
  • H donors: 6 H acceptors: 8 LogP: 5.67 Rotable bonds: 21
    Rule of 5 violations (Lipinski): 3
  • SMILES: OC(=O)C(F)(F)F.N/C(=N/C(=O)CCCn1nnc(c1)c1ccccc1)/NCCC[C@H](C(=O)NCc1ccc(cc1)O)NC(=O)C(c1ccccc1)c1ccccc1
  • InChi: 1S/C39H42N8O4.C2HF3O2/c40-39(44-35(49)19-11-25-47-27-34(45-46-47)29-12-4-1-5-13-29)41-24-10-18-33(37(50)42-26-28-20-22-32(48)23-21-28)43-38(51)36(30-14-6-2-7-15-30)31-16-8-3-9-17-31;3-2(4,5)1(6)7/h1-9,12-17,20-23,27,33,36,48H,10-11,18-19,24-26H2,(H,42,50)(H,43,51)(H3,40,41,44,49);(H,6,7)/t33-;/m1./s1
  • InChiKey: RENMJQLPRIEKCC-MGDILKBHSA-N  

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens neuropeptide Y receptor Y1 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
Brugia malayi follicle stimulating hormone receptor neuropeptide Y receptor Y1 384 aa 345 aa 22.0 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0035 1 1
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0035 1 1
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Schistosoma mansoni steroid dehydrogenase 0.0035 1 0.5
Brugia malayi oxidoreductase 0.0035 1 1
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Entamoeba histolytica hypothetical protein, conserved 0.0035 1 0.5
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0035 1 1
Leishmania major quinonoid dihydropteridine reductase 0.0035 1 1
Mycobacterium tuberculosis Probable short-chain dehydrogenase/reductase 0.0035 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0035 1 1
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0035 1 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Leishmania major hypothetical protein, conserved 0.0035 1 1
Echinococcus granulosus 3 ketodihydrosphingosine reductase 0.0035 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Mycobacterium tuberculosis Possible iron-regulated short-chain dehydrogenase/reductase 0.0035 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 1 1
Leishmania major short chain dehydrogenase, putative 0.0035 1 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Mycobacterium ulcerans 3-alpha-hydroxysteroid dehydrogenase 0.0035 1 1
Trypanosoma brucei beta-ketoacyl-ACP reductase 3, putative 0.0035 1 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0035 1 0.5
Echinococcus granulosus carbonyl reductase 1 0.0035 1 0.5
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0035 1 0.5
Loa Loa (eye worm) oxidoreductase 0.0035 1 1
Toxoplasma gondii oxidoreductase, putative 0.0035 1 0.5
Echinococcus multilocularis conserved hypothetical protein 0.0035 1 0.5
Echinococcus granulosus hypothetical protein 0.0035 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 1 1
Loa Loa (eye worm) hypothetical protein 0.0035 1 1
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 0.5
Schistosoma mansoni short-chain dehydrogenase/reductase 0.0035 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 1 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0035 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Mycobacterium tuberculosis Probable dehydrogenase 0.0035 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0035 1 0.5
Trypanosoma brucei 3-ketoacyl-CoA reductase, putative 0.0035 1 1
Entamoeba histolytica oxidoreductase, short chain dehydrogenase/reductase family 0.0035 1 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0035 1 0.5
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0035 1 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0035 1 1
Onchocerca volvulus Sepiapterin reductase homolog 0.0035 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0035 1 1
Schistosoma mansoni steroid dehydrogenase 0.0035 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Leishmania major hypothetical protein, conserved 0.0035 1 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0035 1 0.5
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0035 1 1
Loa Loa (eye worm) hypothetical protein 0.0035 1 1
Onchocerca volvulus 0.0035 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0035 1 0.5
Echinococcus multilocularis steroid dehydrogenase 0.0035 1 0.5
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0035 1 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0035 1 1
Schistosoma mansoni carbonyl reductase 0.0035 1 0.5
Echinococcus multilocularis epidermal retinal dehydrogenase 2 0.0035 1 0.5
Onchocerca volvulus 0.0035 1 0.5
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0035 1 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Mycobacterium ulcerans ketoacyl reductase 0.0035 1 1
Echinococcus multilocularis Dehydrogenase:reductase SDR family 0.0035 1 0.5
Trypanosoma brucei short-chain dehydrogenase, putative 0.0035 1 1
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 13 homolog 0.0035 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 1 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0035 1 1
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0035 1 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0035 1 0.5
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0035 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0035 1 1
Trypanosoma brucei 3-keto-dihydrosphingosine reductase 0.0035 1 1
Onchocerca volvulus 0.0035 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Echinococcus multilocularis oxidoreductase 0.0035 1 0.5
Plasmodium vivax steroid dehydrogenase, putative 0.0035 1 0.5
Trichomonas vaginalis estradiol 17 beta-dehydrogenase, putative 0.0035 1 0.5
Plasmodium falciparum steroid dehydrogenase, putative 0.0035 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0035 1 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0035 1 0.5
Toxoplasma gondii oxidoreductase, putative 0.0035 1 0.5
Brugia malayi hypothetical protein 0.0035 1 1
Echinococcus multilocularis carbonyl reductase 1 0.0035 1 0.5
Mycobacterium tuberculosis Possible ketoacyl reductase 0.0035 1 0.5
Mycobacterium ulcerans short-chain dehydrogenase 0.0035 1 1
Trypanosoma brucei short-chain dehydrogenase, putative 0.0035 1 1
Mycobacterium tuberculosis Possible short-chain dehydrogenase EphD 0.0035 1 0.5
Onchocerca volvulus 0.0035 1 0.5
Mycobacterium tuberculosis Possible multi-functional enzyme with acyl-CoA-reductase activity AcrA1 0.0035 1 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0035 1 0.5
Giardia lamblia Short-chain dehydrogenase, putative 0.0035 1 0.5
Mycobacterium ulcerans short-chain dehydrogenase 0.0035 1 1
Mycobacterium ulcerans dehydrogenase 0.0035 1 1
Brugia malayi hypothetical protein 0.0035 1 1
Mycobacterium tuberculosis Probable shortchain dehydrogenase 0.0035 1 0.5
Toxoplasma gondii carbonyl reductase 1, putative 0.0035 1 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0035 1 1
Loa Loa (eye worm) oxidoreductase 0.0035 1 1
Leishmania major hypothetical protein, conserved 0.0035 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0035 1 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0035 1 1
Echinococcus granulosus WW domain containing oxidoreductase 0.0035 1 0.5
Leishmania major hypothetical protein, conserved 0.0035 1 1
Leishmania major short chain dehydrogenase/reductase, putative 0.0035 1 1
Loa Loa (eye worm) hypothetical protein 0.0035 1 1
Mycobacterium ulcerans short-chain dehydrogenase 0.0035 1 1
Schistosoma mansoni steroid dehydrogenase 0.0035 1 0.5
Brugia malayi dehydrogenases, short chain protein 9 0.0035 1 1
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Echinococcus multilocularis carbonyl reductase 1 0.0035 1 0.5
Loa Loa (eye worm) cytochrome P450 family protein 0.0029 0.6534 0.6534
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Echinococcus multilocularis retinol dehydrogenase 11 0.0035 1 0.5
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0035 1 0.5
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0035 1 0.5
Loa Loa (eye worm) short chain dehydrogenase/reductase family oxidoreductase 0.0035 1 1
Schistosoma mansoni retinal dehydrogenase 0.0035 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0035 1 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Entamoeba histolytica 3-ketodihydrosphingosine reductase protein, putative 0.0035 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0035 1 0.5
Giardia lamblia Reductase, putative 0.0035 1 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0035 1 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0035 1 0.5
Onchocerca volvulus 0.0035 1 0.5
Mycobacterium ulcerans short-chain type oxidoreductase 0.0035 1 1
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Mycobacterium tuberculosis Possible oxidoreductase 0.0035 1 0.5
Mycobacterium tuberculosis Possible oxidoreductase 0.0035 1 0.5
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0035 1 1
Leishmania major hypothetical protein, conserved 0.0035 1 1
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0035 1 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0035 1 0.5
Mycobacterium tuberculosis Possible fatty acyl-CoA reductase 0.0035 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 1 1
Echinococcus granulosus hypothetical protein 0.0035 1 0.5
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0035 1 0.5
Onchocerca volvulus 0.0035 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Leishmania major short chain dehydrogenase/reductase, putative 0.0035 1 1
Echinococcus multilocularis retinol dehydrogenase 11 0.0035 1 0.5
Entamoeba histolytica hypothetical protein 0.0035 1 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0035 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Brugia malayi dehydrogenases, short chain protein 2 0.0035 1 1
Echinococcus granulosus oxidoreductase 0.0035 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 1 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Loa Loa (eye worm) oxidoreductase 0.0035 1 1
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0035 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Giardia lamblia Hypothetical protein 0.0035 1 0.5
Toxoplasma gondii 3-ketoacyl-CoA reductase, putative 0.0035 1 0.5
Onchocerca volvulus 0.0035 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0035 1 1
Echinococcus granulosus steroid dehydrogenase 0.0035 1 0.5
Leishmania major short chain dehydrogenase-like protein 0.0035 1 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0035 1 0.5
Wolbachia endosymbiont of Brugia malayi Short-chain alcohol dehydrogenase family enzyme 0.0035 1 0.5
Brugia malayi Retinol dehydrogenase 12 0.0035 1 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0035 1 0.5
Mycobacterium ulcerans short-chain membrane-associated dehydrogenase 0.0035 1 1
Loa Loa (eye worm) dehydrogenase 0.0035 1 1
Echinococcus granulosus carbonyl reductase 1 0.0035 1 0.5
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0035 1 0.5
Mycobacterium leprae Probable short-chain type dehydrogenase/reductase 0.0035 1 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0035 1 0.5
Loa Loa (eye worm) dehydrogenase 0.0035 1 1
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 0.5
Mycobacterium tuberculosis Probable short chain alcohol dehydrogenase/reductase 0.0035 1 0.5
Echinococcus granulosus epidermal retinal dehydrogenase 2 0.0035 1 0.5
Trypanosoma cruzi quinonoid dihydropteridine reductase, putative 0.0035 1 1
Mycobacterium tuberculosis Decaprenylphosphoryl-D-2-keto erythro pentose reductase 0.0035 1 0.5
Trypanosoma brucei oxidoreductase-like protein 0.0035 1 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 1 homolog 0.0035 1 0.5
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0035 1 1
Mycobacterium ulcerans ketoacyl reductase 0.0035 1 1
Toxoplasma gondii 2,4-dienoyl CoA reductase 2, peroxisomal family protein 0.0035 1 0.5
Brugia malayi Dehydrogenases, short chain protein 2 0.0035 1 1
Echinococcus multilocularis retinol dehydrogenase 13 0.0035 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0035 1 0.5
Echinococcus granulosus retinol dehydrogenase 11 0.0035 1 0.5
Echinococcus multilocularis transient receptor potential cation channel 0.0035 1 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0035 1 0.5
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 13 homolog 0.0035 1 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0035 1 0.5
Onchocerca volvulus 0.0035 1 0.5
Mycobacterium tuberculosis Probable dehydrogenase/reductase 0.0035 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Echinococcus multilocularis estradiol 17 beta dehydrogenase 12 0.0035 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Leishmania major oxidoreductase-like protein 0.0035 1 1
Schistosoma mansoni 3-keto-dihydrosphingosine reductase 0.0035 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0035 1 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0035 1 1
Onchocerca volvulus 0.0035 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0035 1 1
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0035 1 1
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0035 1 1
Mycobacterium ulcerans dehydrogenase/reductase 0.0035 1 1
Trichomonas vaginalis hydroxyacyl dehydrogenase, putative 0.0035 1 0.5
Leishmania major short chain dehydrogenase, putative 0.0035 1 1
Loa Loa (eye worm) oxidoreductase 0.0035 1 1
Entamoeba histolytica short chain dehydrogenase family protein 0.0035 1 0.5
Mycobacterium ulcerans oxidoreductase 0.0035 1 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0035 1 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0035 1 0.5
Schistosoma mansoni oxidoreductase short chain dehydrogenase/reductase family 0.0035 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0035 1 1
Echinococcus multilocularis steroid dehydrogenase 0.0035 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0035 1 1
Trypanosoma cruzi short chain dehydrogenase, putative 0.0035 1 1
Echinococcus granulosus carbonyl reductase 1 0.0035 1 0.5
Leishmania major 3-keto-dihydrosphingosine reductase 0.0035 1 1
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0035 1 1
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Onchocerca volvulus 0.0035 1 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0035 1 1
Echinococcus granulosus Dehydrogenase:reductase SDR family 0.0035 1 0.5
Plasmodium vivax hypothetical protein, conserved 0.0035 1 0.5
Toxoplasma gondii sterol carrier protein-2 HAD-2SCP-2 0.0035 1 0.5
Mycobacterium ulcerans ketoacyl reductase 0.0035 1 1
Loa Loa (eye worm) oxidoreductase 0.0035 1 1
Mycobacterium ulcerans carveol-like dehydrogenase 0.0035 1 1
Mycobacterium leprae Probable oxidoreductase 0.0035 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Mycobacterium ulcerans dehydrogenase/decarboxylase protein 0.0035 1 1
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Trypanosoma brucei beta-ketoacyl-ACP reductase 2 0.0035 1 1
Loa Loa (eye worm) oxidoreductase 0.0035 1 1
Entamoeba histolytica short chain dehydrogenase family protein 0.0035 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Entamoeba histolytica hypothetical protein, conserved 0.0035 1 0.5
Mycobacterium leprae PROBABLE SHORT CHAIN ALCOHOL DEHYDROGENASE/REDUCTASE 0.0035 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Echinococcus multilocularis 3 ketodihydrosphingosine reductase 0.0035 1 0.5
Brugia malayi Cytochrome P450 family protein 0.0029 0.6534 0.6534
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Mycobacterium leprae ROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCTASE 0.0035 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0035 1 1
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Leishmania major dehydrogenase-like protein 0.0035 1 1
Schistosoma mansoni carbonyl reductase 0.0035 1 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0035 1 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0035 1 1
Leishmania major quinonoid dihydropteridine reductase 0.0035 1 1
Onchocerca volvulus 0.0035 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Schistosoma mansoni steroid dehydrogenase 0.0035 1 0.5
Schistosoma mansoni carbonyl reductase 0.0035 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 1 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Brugia malayi Hypothetical oxidoreductase F56D1.5 0.0035 1 1
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0035 1 1
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0035 1 1
Mycobacterium ulcerans oxidoreductase 0.0035 1 1
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0035 1 1
Trypanosoma brucei short-chain dehydrogenase, putative 0.0035 1 1
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Onchocerca volvulus 0.0035 1 0.5
Loa Loa (eye worm) oxidoreductase 0.0035 1 1
Loa Loa (eye worm) oxidoreductase 0.0035 1 1
Mycobacterium tuberculosis Probable short-chain type oxidoreductase 0.0035 1 0.5
Trypanosoma brucei beta-D-hydroxybutyrate dehydrogenase 0.0035 1 1
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Mycobacterium tuberculosis Probable dehydrogenase/reductase 0.0035 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0035 1 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 0.5
Brugia malayi Dehydrogenases, short chain protein 30 0.0035 1 1
Onchocerca volvulus 0.0035 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0035 1 0.5
Mycobacterium leprae Possible short-chain dehydrogenase EphD 0.0035 1 0.5
Schistosoma mansoni steroid dehydrogenase 0.0035 1 0.5
Leishmania major pteridine reductase 1 0.0035 1 1
Loa Loa (eye worm) oxidoreductase 0.0035 1 1
Mycobacterium ulcerans short-chain dehydrogenase 0.0035 1 1
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0035 1 1
Giardia lamblia Oxidoreductase, short chain dehydrogenase/reductase family 0.0035 1 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 1
Mycobacterium leprae Probable short-chain type dehydrogenase/reductase 0.0035 1 0.5
Echinococcus granulosus carbonyl reductase 1 0.0035 1 0.5
Plasmodium falciparum oxidoreductase, short-chain dehydrogenase family, putative 0.0035 1 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0035 1 1
Brugia malayi D-beta-hydroxybutyrate dehydrogenase, mitochondrial precursor 0.0035 1 1
Trichomonas vaginalis short-chain dehydrogenases/reductase, putative 0.0035 1 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0035 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Trypanosoma brucei short-chain dehydrogenase, putative 0.0035 1 1
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0035 1 0.5
Echinococcus granulosus retinol dehydrogenase 11 0.0035 1 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Mycobacterium ulcerans short chain dehydrogenase 0.0035 1 1
Trypanosoma cruzi short chain dehydrogenase, putative 0.0035 1 1
Trichomonas vaginalis steroid dehydrogenase, putative 0.0035 1 0.5
Schistosoma mansoni short chain dehydrogenase 0.0035 1 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0035 1 1
Trypanosoma brucei short-chain dehydrogenase, putative 0.0035 1 1

Activities

Activity type Activity value Assay description Source Reference
Kb (functional) = 0.9 nM Antagonist activity at NPY Y1 receptor in HEL cells assessed as inhibition of NPY-induced increase in intracellular calcium mobilization by Fura-2 assay ChEMBL. 18851917
Ki (binding) = 49 nM Displacement of NG-([2,3-3H]propionyl)-BIBP-3226 from NPY Y1 receptor in human SK-N-MC cells ChEMBL. 18851917

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.