Detailed information for compound 405280

Basic information

Technical information
  • TDR Targets ID: 405280
  • Name: (2S,3S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2 S)-2-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[ (2S,3S)-2-amino-3-methylpentanoyl]amino]-5-(d iaminomethylideneamino)pentanoyl]amino]hexano yl]amino]-3-methylpentanoyl]amino]-4-methylpe ntanoyl]amino]-3-phenylpropanoyl]amino]-4-met hylpentanoyl]amino]-4-hydroxy-4-oxobutanoyl]a mino]acetyl]amino]-3-methylpentanoic acid
  • MW: 1187.47 | Formula: C57H98N14O13
  • H donors: 15 H acceptors: 13 LogP: -2.07 Rotable bonds: 50
    Rule of 5 violations (Lipinski): 4
  • SMILES: NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H]([C@H](CC)C)C(=O)O)CC(=O)O)CC(C)C)Cc1ccccc1)CC(C)C)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)N)CCCN=C(N)N
  • InChi: 1S/C57H98N14O13/c1-11-33(8)45(59)54(81)65-38(23-19-25-62-57(60)61)49(76)64-37(22-17-18-24-58)50(77)71-46(34(9)12-2)55(82)69-40(27-32(6)7)52(79)67-41(28-36-20-15-14-16-21-36)53(80)66-39(26-31(4)5)51(78)68-42(29-44(73)74)48(75)63-30-43(72)70-47(56(83)84)35(10)13-3/h14-16,20-21,31-35,37-42,45-47H,11-13,17-19,22-30,58-59H2,1-10H3,(H,63,75)(H,64,76)(H,65,81)(H,66,80)(H,67,79)(H,68,78)(H,69,82)(H,70,72)(H,71,77)(H,73,74)(H,83,84)(H4,60,61,62)/t33-,34-,35-,37-,38-,39-,40-,41-,42-,45-,46-,47-/m0/s1
  • InChiKey: DNGHLMOUASDWRU-CCKIYBGTSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (2S,3S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methyl-pentanoyl]amino]-5-guanidino-pentanoyl]amino]hexanoyl]amino]-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoyl]amino]-4-hydroxy-4-oxo-butanoyl]amino]acetyl]amino]-3-methyl-pentanoic acid
  • (2S,3S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methyl-1-oxopentyl]amino]-5-guanidino-1-oxopentyl]amino]-1-oxohexyl]amino]-3-methyl-1-oxopentyl]amino]-4-methyl-1-oxopentyl]amino]-1-oxo-3-phenylpropyl]amino]-4-methyl-1-oxopentyl]amino]-4-hydroxy-1,4-dioxobutyl]amino]-1-oxoethyl]amino]-3-methylpentanoic acid
  • (2S,3S)-2-[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-6-azanyl-2-[[(2S)-2-[[(2S,3S)-2-azanyl-3-methyl-pentanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]hexanoyl]amino]-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoyl]amino]-4-hydroxy-4-oxo-butanoyl]amino]ethanoylamino]-3-methyl-pentanoic acid
  • (2S,3S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methyl-pentanoyl]amino]-5-guanidino-pentanoyl]amino]hexanoyl]amino]-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoyl]amino]-4-hydroxy-4-keto-butanoyl]amino]acetyl]amino]-3-methyl-valeric acid

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
Loa Loa (eye worm) oxidoreductase 0.0019 0.4322 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0019 0.4322 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0019 0.4322 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0019 0.4322 0.5
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0019 0.4322 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0019 0.4322 1
Loa Loa (eye worm) tubulin gamma chain 0.0014 0.243 0.5623
Schistosoma mansoni retinal dehydrogenase 0.0019 0.4322 1
Schistosoma mansoni steroid dehydrogenase 0.0019 0.4322 1
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0019 0.4322 1
Brugia malayi hypothetical protein 0.0019 0.4322 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Leishmania major oxidoreductase-like protein 0.0019 0.4322 1
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Trypanosoma cruzi short chain dehydrogenase, putative 0.0019 0.4322 1
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0019 0.4322 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0014 0.243 0.5623
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Trichomonas vaginalis tubulin alpha chain, putative 0.0014 0.243 0.5623
Echinococcus multilocularis Dehydrogenase:reductase SDR family 0.0019 0.4322 1
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0019 0.4322 1
Wolbachia endosymbiont of Brugia malayi Short-chain alcohol dehydrogenase family enzyme 0.0019 0.4322 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Schistosoma mansoni short-chain dehydrogenase/reductase 0.0019 0.4322 1
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0019 0.4322 1
Loa Loa (eye worm) oxidoreductase 0.0019 0.4322 1
Brugia malayi Tubulin beta-1 chain 0.0014 0.243 0.5623
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Entamoeba histolytica hypothetical protein, conserved 0.0019 0.4322 1
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0019 0.4322 1
Trypanosoma brucei alpha tubulin 0.0014 0.243 0.5623
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Trichomonas vaginalis tubulin beta chain, putative 0.0014 0.243 0.5623
Mycobacterium tuberculosis Possible short-chain dehydrogenase EphD 0.0019 0.4322 0.5
Loa Loa (eye worm) beta-tubulin 0.0014 0.243 0.5623
Onchocerca volvulus 0.0019 0.4322 0.4322
Leishmania major hypothetical protein, conserved 0.0019 0.4322 1
Trypanosoma cruzi quinonoid dihydropteridine reductase, putative 0.0019 0.4322 1
Loa Loa (eye worm) BEN-1 protein 0.0014 0.243 0.5623
Brugia malayi Retinol dehydrogenase 12 0.0019 0.4322 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0019 0.4322 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0014 0.243 0.5623
Trichomonas vaginalis tubulin beta chain, putative 0.0014 0.243 0.5623
Echinococcus granulosus carbonyl reductase 1 0.0019 0.4322 1
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 1 homolog 0.0019 0.4322 0.4322
Onchocerca volvulus 0.0019 0.4322 0.4322
Echinococcus multilocularis epidermal retinal dehydrogenase 2 0.0019 0.4322 1
Loa Loa (eye worm) oxidoreductase 0.0019 0.4322 1
Echinococcus granulosus carbonyl reductase 1 0.0019 0.4322 1
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0019 0.4322 1
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0019 0.4322 1
Echinococcus granulosus steroid dehydrogenase 0.0019 0.4322 1
Plasmodium vivax hypothetical protein, conserved 0.0019 0.4322 1
Echinococcus granulosus carbonyl reductase 1 0.0019 0.4322 1
Mycobacterium leprae Probable short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Trichomonas vaginalis tubulin gamma chain, putative 0.0014 0.243 0.5623
Echinococcus multilocularis transient receptor potential cation channel 0.0019 0.4322 1
Trichomonas vaginalis tubulin gamma chain, putative 0.0014 0.243 0.5623
Brugia malayi D-beta-hydroxybutyrate dehydrogenase, mitochondrial precursor 0.0019 0.4322 1
Leishmania major dehydrogenase-like protein 0.0019 0.4322 1
Loa Loa (eye worm) tubulin alpha chain 0.0014 0.243 0.5623
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Loa Loa (eye worm) alpha-tubulin 0.0014 0.243 0.5623
Brugia malayi Dehydrogenases, short chain protein 30 0.0019 0.4322 1
Giardia lamblia Reductase, putative 0.0019 0.4322 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Toxoplasma gondii sterol carrier protein-2 HAD-2SCP-2 0.0019 0.4322 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0019 0.4322 1
Schistosoma mansoni steroid dehydrogenase 0.0019 0.4322 1
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0019 0.4322 1
Loa Loa (eye worm) oxidoreductase 0.0019 0.4322 1
Echinococcus multilocularis steroid dehydrogenase 0.0019 0.4322 1
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0019 0.4322 1
Leishmania major hypothetical protein, conserved 0.0019 0.4322 1
Trypanosoma cruzi hypothetical protein, conserved 0.0019 0.4322 1
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Brugia malayi hypothetical protein 0.0019 0.4322 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.4322 1
Giardia lamblia Oxidoreductase, short chain dehydrogenase/reductase family 0.0019 0.4322 1
Echinococcus multilocularis carbonyl reductase 1 0.0019 0.4322 1
Onchocerca volvulus 0.0019 0.4322 0.4322
Mycobacterium ulcerans oxidoreductase 0.0019 0.4322 0.5
Mycobacterium leprae PROBABLE SHORT CHAIN ALCOHOL DEHYDROGENASE/REDUCTASE 0.0019 0.4322 0.5
Echinococcus granulosus retinol dehydrogenase 11 0.0019 0.4322 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Giardia lamblia Hypothetical protein 0.0019 0.4322 1
Onchocerca volvulus 0.0019 0.4322 0.4322
Schistosoma mansoni steroid dehydrogenase 0.0019 0.4322 1
Mycobacterium tuberculosis Probable short chain alcohol dehydrogenase/reductase 0.0019 0.4322 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.4322 1
Onchocerca volvulus 0.0019 0.4322 0.4322
Loa Loa (eye worm) oxidoreductase 0.0019 0.4322 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0019 0.4322 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Brugia malayi tubulin alpha chain - mouse 0.0014 0.243 0.5623
Loa Loa (eye worm) tubulin beta-2A chain 0.0014 0.243 0.5623
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0019 0.4322 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0019 0.4322 0.5
Onchocerca volvulus 0.0019 0.4322 0.4322
Trichomonas vaginalis estradiol 17 beta-dehydrogenase, putative 0.0019 0.4322 1
Entamoeba histolytica 3-ketodihydrosphingosine reductase protein, putative 0.0019 0.4322 1
Schistosoma mansoni carbonyl reductase 0.0019 0.4322 1
Echinococcus granulosus oxidoreductase 0.0019 0.4322 1
Echinococcus granulosus WW domain containing oxidoreductase 0.0019 0.4322 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0019 0.4322 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Mycobacterium ulcerans 3-alpha-hydroxysteroid dehydrogenase 0.0019 0.4322 0.5
Loa Loa (eye worm) hypothetical protein 0.0019 0.4322 1
Mycobacterium tuberculosis Probable shortchain dehydrogenase 0.0019 0.4322 0.5
Toxoplasma gondii oxidoreductase, putative 0.0019 0.4322 1
Trypanosoma brucei epsilon tubulin 0.0014 0.243 0.5623
Trichomonas vaginalis tubulin gamma chain, putative 0.0014 0.243 0.5623
Mycobacterium tuberculosis Possible oxidoreductase 0.0019 0.4322 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0019 0.4322 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.4322 1
Entamoeba histolytica short chain dehydrogenase family protein 0.0019 0.4322 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0019 0.4322 0.5
Schistosoma mansoni steroid dehydrogenase 0.0019 0.4322 1
Mycobacterium tuberculosis Probable dehydrogenase/reductase 0.0019 0.4322 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Mycobacterium ulcerans short-chain dehydrogenase 0.0019 0.4322 0.5
Mycobacterium tuberculosis Possible ketoacyl reductase 0.0019 0.4322 0.5
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Trypanosoma brucei beta tubulin 0.0014 0.243 0.5623
Mycobacterium ulcerans carveol-like dehydrogenase 0.0019 0.4322 0.5
Echinococcus granulosus epidermal retinal dehydrogenase 2 0.0019 0.4322 1
Onchocerca volvulus 0.0019 0.4322 0.4322
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Mycobacterium tuberculosis Possible fatty acyl-CoA reductase 0.0019 0.4322 0.5
Onchocerca volvulus 0.0019 0.4322 0.4322
Mycobacterium tuberculosis Probable dehydrogenase/reductase 0.0019 0.4322 0.5
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 13 homolog 0.0019 0.4322 0.4322
Loa Loa (eye worm) hypothetical protein 0.0019 0.4322 1
Trypanosoma brucei beta-ketoacyl-ACP reductase 2 0.0019 0.4322 1
Echinococcus multilocularis conserved hypothetical protein 0.0019 0.4322 1
Mycobacterium ulcerans short-chain membrane-associated dehydrogenase 0.0019 0.4322 0.5
Toxoplasma gondii carbonyl reductase 1, putative 0.0019 0.4322 1
Leishmania major quinonoid dihydropteridine reductase 0.0019 0.4322 1
Trypanosoma brucei short-chain dehydrogenase, putative 0.0019 0.4322 1
Leishmania major short chain dehydrogenase-like protein 0.0019 0.4322 1
Plasmodium vivax steroid dehydrogenase, putative 0.0019 0.4322 1
Mycobacterium ulcerans oxidoreductase 0.0019 0.4322 0.5
Loa Loa (eye worm) hypothetical protein 0.0014 0.243 0.5623
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0019 0.4322 0.5
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0019 0.4322 1
Mycobacterium tuberculosis Probable short-chain type oxidoreductase 0.0019 0.4322 0.5
Trichomonas vaginalis tubulin beta chain, putative 0.0014 0.243 0.5623
Echinococcus multilocularis 3 ketodihydrosphingosine reductase 0.0019 0.4322 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0019 0.4322 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Schistosoma mansoni carbonyl reductase 0.0019 0.4322 1
Loa Loa (eye worm) oxidoreductase 0.0019 0.4322 1
Leishmania major short chain dehydrogenase/reductase, putative 0.0019 0.4322 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Trichomonas vaginalis tubulin beta chain, putative 0.0014 0.243 0.5623
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0019 0.4322 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.4322 1
Loa Loa (eye worm) tubulin alpha-2 chain 0.0014 0.243 0.5623
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Giardia lamblia Short-chain dehydrogenase, putative 0.0019 0.4322 1
Echinococcus granulosus retinol dehydrogenase 11 0.0019 0.4322 1
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0019 0.4322 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0014 0.243 0.5623
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Trichomonas vaginalis hydroxyacyl dehydrogenase, putative 0.0019 0.4322 1
Trypanosoma cruzi hypothetical protein, conserved 0.0019 0.4322 1
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Echinococcus multilocularis estradiol 17 beta dehydrogenase 12 0.0019 0.4322 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.4322 1
Plasmodium falciparum steroid dehydrogenase, putative 0.0019 0.4322 1
Mycobacterium ulcerans dehydrogenase/reductase 0.0019 0.4322 0.5
Loa Loa (eye worm) tubulin beta chain 0.0014 0.243 0.5623
Brugia malayi Tubulin alpha chain 0.0014 0.243 0.5623
Mycobacterium tuberculosis Probable oxidoreductase 0.0019 0.4322 0.5
Brugia malayi tubulin alpha-2 chain 0.0014 0.243 0.5623
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Toxoplasma gondii 3-ketoacyl-CoA reductase, putative 0.0019 0.4322 1
Mycobacterium ulcerans ketoacyl reductase 0.0019 0.4322 0.5
Trichomonas vaginalis tubulin epsilon chain, putative 0.0014 0.243 0.5623
Loa Loa (eye worm) oxidoreductase 0.0019 0.4322 1
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0019 0.4322 1
Trichomonas vaginalis short-chain dehydrogenases/reductase, putative 0.0019 0.4322 1
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Brugia malayi Dehydrogenases, short chain protein 2 0.0019 0.4322 1
Mycobacterium leprae ROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCTASE 0.0019 0.4322 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Trypanosoma brucei alpha tubulin 0.0014 0.243 0.5623
Loa Loa (eye worm) short chain dehydrogenase/reductase family oxidoreductase 0.0019 0.4322 1
Entamoeba histolytica hypothetical protein 0.0019 0.4322 1
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0019 0.4322 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0014 0.243 0.5623
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0019 0.4322 1
Trypanosoma brucei short-chain dehydrogenase, putative 0.0019 0.4322 1
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0019 0.4322 1
Leishmania major hypothetical protein, conserved 0.0019 0.4322 1
Echinococcus granulosus Dehydrogenase:reductase SDR family 0.0019 0.4322 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Leishmania major quinonoid dihydropteridine reductase 0.0019 0.4322 1
Mycobacterium ulcerans short-chain dehydrogenase 0.0019 0.4322 0.5
Leishmania major hypothetical protein, conserved 0.0019 0.4322 1
Loa Loa (eye worm) alpha-tubulin 0.0014 0.243 0.5623
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Echinococcus multilocularis retinol dehydrogenase 11 0.0019 0.4322 1
Trypanosoma brucei oxidoreductase-like protein 0.0019 0.4322 1
Entamoeba histolytica short chain dehydrogenase family protein 0.0019 0.4322 1
Mycobacterium ulcerans dehydrogenase 0.0019 0.4322 0.5
Loa Loa (eye worm) hypothetical protein 0.0019 0.4322 1
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Echinococcus granulosus hypothetical protein 0.0019 0.4322 1
Leishmania major hypothetical protein, conserved 0.0019 0.4322 1
Trichomonas vaginalis tubulin beta chain, putative 0.0014 0.243 0.5623
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0019 0.4322 1
Trypanosoma brucei alpha tubulin 0.0014 0.243 0.5623
Entamoeba histolytica hypothetical protein, conserved 0.0019 0.4322 1
Leishmania major quinonoid dihydropteridine reductase 0.0019 0.4322 1
Echinococcus multilocularis retinol dehydrogenase 13 0.0019 0.4322 1
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0019 0.4322 1
Leishmania major 3-keto-dihydrosphingosine reductase 0.0019 0.4322 1
Trypanosoma cruzi hypothetical protein, conserved 0.0019 0.4322 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0019 0.4322 1
Brugia malayi Tubulin gamma chain 0.0014 0.243 0.5623
Brugia malayi oxidoreductase 0.0019 0.4322 1
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Loa Loa (eye worm) oxidoreductase 0.0019 0.4322 1
Leishmania major short chain dehydrogenase, putative 0.0019 0.4322 1
Leishmania major pteridine reductase 1 0.0019 0.4322 1
Entamoeba histolytica oxidoreductase, short chain dehydrogenase/reductase family 0.0019 0.4322 1
Plasmodium falciparum oxidoreductase, short-chain dehydrogenase family, putative 0.0019 0.4322 1
Loa Loa (eye worm) tubulin beta-1 chain 0.0014 0.243 0.5623
Trypanosoma brucei 3-keto-dihydrosphingosine reductase 0.0019 0.4322 1
Brugia malayi alpha-tubulin 0.0014 0.243 0.5623
Mycobacterium ulcerans ketoacyl reductase 0.0019 0.4322 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Brugia malayi Hypothetical oxidoreductase F56D1.5 0.0019 0.4322 1
Echinococcus multilocularis steroid dehydrogenase 0.0019 0.4322 1
Echinococcus granulosus 3 ketodihydrosphingosine reductase 0.0019 0.4322 1
Mycobacterium ulcerans short-chain dehydrogenase 0.0019 0.4322 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Onchocerca volvulus 0.0019 0.4322 0.4322
Trypanosoma brucei beta tubulin 0.0014 0.243 0.5623
Mycobacterium tuberculosis Possible oxidoreductase 0.0019 0.4322 0.5
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0019 0.4322 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.4322 1
Mycobacterium ulcerans ketoacyl reductase 0.0019 0.4322 0.5
Schistosoma mansoni steroid dehydrogenase 0.0019 0.4322 1
Onchocerca volvulus 0.0019 0.4322 0.4322
Trypanosoma brucei epsilon tubulin 0.0014 0.243 0.5623
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0019 0.4322 1
Trypanosoma brucei alpha tubulin 0.0014 0.243 0.5623
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0019 0.4322 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Trypanosoma brucei tubulin gamma chain 0.0014 0.243 0.5623
Mycobacterium leprae Probable short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Trypanosoma brucei beta-ketoacyl-ACP reductase 3, putative 0.0019 0.4322 1
Trypanosoma brucei beta-D-hydroxybutyrate dehydrogenase 0.0019 0.4322 1
Onchocerca volvulus Sepiapterin reductase homolog 0.0019 0.4322 0.4322
Echinococcus multilocularis oxidoreductase 0.0019 0.4322 1
Trypanosoma brucei beta tubulin 0.0014 0.243 0.5623
Echinococcus multilocularis carbonyl reductase 1 0.0019 0.4322 1
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Brugia malayi Tubulin alpha-2 chain 0.0014 0.243 0.5623
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Toxoplasma gondii 2,4-dienoyl CoA reductase 2, peroxisomal family protein 0.0019 0.4322 1
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0019 0.4322 1
Mycobacterium tuberculosis Decaprenylphosphoryl-D-2-keto erythro pentose reductase 0.0019 0.4322 0.5
Loa Loa (eye worm) BEN-1 protein 0.0014 0.243 0.5623
Leishmania major short chain dehydrogenase/reductase, putative 0.0019 0.4322 1
Schistosoma mansoni steroid dehydrogenase 0.0019 0.4322 1
Loa Loa (eye worm) tubulin beta-4 chain 0.0014 0.243 0.5623
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Trichomonas vaginalis steroid dehydrogenase, putative 0.0019 0.4322 1
Leishmania major quinonoid dihydropteridine reductase 0.0019 0.4322 1
Mycobacterium leprae Probable oxidoreductase 0.0019 0.4322 0.5
Loa Loa (eye worm) hypothetical protein 0.0019 0.4322 1
Trypanosoma brucei short-chain dehydrogenase, putative 0.0019 0.4322 1
Trypanosoma cruzi hypothetical protein, conserved 0.0019 0.4322 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0019 0.4322 1
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Trypanosoma brucei beta tubulin 0.0014 0.243 0.5623
Mycobacterium tuberculosis Possible multi-functional enzyme with acyl-CoA-reductase activity AcrA1 0.0019 0.4322 0.5
Echinococcus multilocularis retinol dehydrogenase 11 0.0019 0.4322 1
Loa Loa (eye worm) oxidoreductase 0.0019 0.4322 1
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Trichomonas vaginalis tubulin, putative 0.0014 0.243 0.5623
Loa Loa (eye worm) tubulin alpha chain 0.0014 0.243 0.5623
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0019 0.4322 1
Trypanosoma cruzi short chain dehydrogenase, putative 0.0019 0.4322 1
Schistosoma mansoni carbonyl reductase 0.0019 0.4322 1
Leishmania major quinonoid dihydropteridine reductase 0.0019 0.4322 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Schistosoma mansoni steroid dehydrogenase 0.0019 0.4322 1
Schistosoma mansoni steroid dehydrogenase 0.0019 0.4322 1
Trypanosoma brucei short-chain dehydrogenase, putative 0.0019 0.4322 1
Brugia malayi Tubulin alpha-2 chain 0.0014 0.243 0.5623
Echinococcus granulosus hypothetical protein 0.0019 0.4322 1
Mycobacterium tuberculosis Possible iron-regulated short-chain dehydrogenase/reductase 0.0019 0.4322 0.5
Mycobacterium ulcerans dehydrogenase/decarboxylase protein 0.0019 0.4322 0.5
Onchocerca volvulus 0.0019 0.4322 0.4322
Trypanosoma brucei beta tubulin 0.0014 0.243 0.5623
Schistosoma mansoni steroid dehydrogenase 0.0019 0.4322 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Leishmania major short chain dehydrogenase, putative 0.0019 0.4322 1
Trichomonas vaginalis tubulin beta chain, putative 0.0014 0.243 0.5623
Mycobacterium leprae Possible short-chain dehydrogenase EphD 0.0019 0.4322 0.5
Trichomonas vaginalis tubulin beta chain, putative 0.0014 0.243 0.5623
Loa Loa (eye worm) hypothetical protein 0.0019 0.4322 1
Schistosoma mansoni oxidoreductase short chain dehydrogenase/reductase family 0.0019 0.4322 1
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0014 0.243 0.5623
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0019 0.4322 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Trypanosoma brucei 3-ketoacyl-CoA reductase, putative 0.0019 0.4322 1
Onchocerca volvulus 0.0019 0.4322 0.4322
Mycobacterium ulcerans short-chain type oxidoreductase 0.0019 0.4322 0.5
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 13 homolog 0.0019 0.4322 0.4322
Toxoplasma gondii oxidoreductase, putative 0.0019 0.4322 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Brugia malayi beta-tubulin, identical 0.0014 0.243 0.5623
Schistosoma mansoni 3-keto-dihydrosphingosine reductase 0.0019 0.4322 1
Mycobacterium tuberculosis Probable short-chain dehydrogenase/reductase 0.0019 0.4322 0.5
Onchocerca volvulus 0.0019 0.4322 0.4322
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Mycobacterium ulcerans short-chain dehydrogenase 0.0019 0.4322 0.5
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Trypanosoma brucei short-chain dehydrogenase, putative 0.0019 0.4322 1
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Trypanosoma brucei epsilon tubulin 0.0014 0.243 0.5623
Mycobacterium tuberculosis Probable dehydrogenase 0.0019 0.4322 0.5
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Schistosoma mansoni steroid dehydrogenase 0.0019 0.4322 1
Echinococcus granulosus carbonyl reductase 1 0.0019 0.4322 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Loa Loa (eye worm) dehydrogenase 0.0019 0.4322 1
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Leishmania major quinonoid dihydropteridine reductase 0.0019 0.4322 1
Brugia malayi dehydrogenases, short chain protein 2 0.0019 0.4322 1
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Mycobacterium ulcerans short chain dehydrogenase 0.0019 0.4322 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0019 0.4322 1
Schistosoma mansoni short chain dehydrogenase 0.0019 0.4322 1
Loa Loa (eye worm) dehydrogenase 0.0019 0.4322 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0019 0.4322 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0019 0.4322 0.5
Brugia malayi dehydrogenases, short chain protein 9 0.0019 0.4322 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) 0 uM In vitro antiviral activity against HIV-1 replication in MT-4 cells was determined by 50% inhibition of syncitia formation : Inactive ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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

No literature references available for this target.

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