Detailed information for compound 458150

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 432.472 | Formula: C24H24N4O4
  • H donors: 3 H acceptors: 4 LogP: 2.94 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)NC[C@@H]1OC(=O)N(C1)c1ccc2c(c1)CCCc1c2[nH]nc1c1ccc(cc1)O
  • InChi: 1S/C24H24N4O4/c1-14(29)25-12-19-13-28(24(31)32-19)17-7-10-20-16(11-17)3-2-4-21-22(26-27-23(20)21)15-5-8-18(30)9-6-15/h5-11,19,30H,2-4,12-13H2,1H3,(H,25,29)(H,26,27)/t19-/m0/s1
  • InChiKey: DWBNMBDPTGJZMY-IBGZPJMESA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Schistosoma mansoni carbonic anhydrase-related 0.0023 0.0695 0.0944
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0005 0.0087 0.0054
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0013 0.034 0.0423
Echinococcus multilocularis nuclear factor of activated T cells 5 0.0044 0.1397 0.1972
Mycobacterium ulcerans 3-oxoacyl-ACP reductase 0.0013 0.034 0.0423
Brugia malayi Protein kinase domain containing protein 0.0009 0.0209 0.0232
Mycobacterium tuberculosis Hypothetical protein 0.0067 0.2191 0.3134
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0023 0.0695 0.0944
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0023 0.0695 0.0944
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0018 0.0512 0.0676
Mycobacterium tuberculosis Possible oxidoreductase 0.0013 0.034 0.0423
Mycobacterium ulcerans short chain dehydrogenase 0.0013 0.034 0.0423
Echinococcus multilocularis mitogen activated protein kinase 3 0.003 0.0939 0.1301
Echinococcus granulosus mitogen activated protein kinase 3 0.003 0.0939 0.1301
Loa Loa (eye worm) cytochrome P450 family protein 0.0013 0.0366 0.0462
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0018 0.0512 0.0676
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.0009 0.02 0.0218
Mycobacterium tuberculosis Probable oxidoreductase 0.0015 0.0416 0.0535
Loa Loa (eye worm) retinol dehydrogenase 12 0.0013 0.034 0.0423
Brugia malayi Immunoglobulin I-set domain containing protein 0.0009 0.02 0.0218
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0018 0.0512 0.0676
Echinococcus granulosus carbonic anhydrase 0.0023 0.0695 0.0944
Wolbachia endosymbiont of Brugia malayi Short-chain alcohol dehydrogenase family enzyme 0.0013 0.034 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0013 0.034 0.0423
Toxoplasma gondii hypothetical protein 0.0004 0.0051 0.0059
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0013 0.034 0.0423
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0017 0.049 0.0644
Mycobacterium ulcerans enoyl-(acyl carrier protein) reductase 0.0013 0.034 0.0423
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0023 0.0695 0.0944
Brugia malayi MAP kinase sur-1 0.003 0.0939 0.1301
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0124 0.4115 0.5952
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0013 0.034 0.0423
Mycobacterium tuberculosis Possible oxidoreductase 0.0013 0.034 0.0423
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0013 0.034 0.0423
Mycobacterium tuberculosis Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase) 0.0205 0.6879 1
Brugia malayi Putative carbonic anhydrase 5 precursor 0.0023 0.0695 0.0944
Echinococcus granulosus mitogen activated protein kinase 0.003 0.0939 0.1301
Echinococcus multilocularis netrin receptor unc 5 0.0009 0.02 0.0218
Echinococcus granulosus 3 oxoacyl acyl carrier protein reductase 0.0013 0.034 0.0423
Entamoeba histolytica 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0013 0.034 1
Trypanosoma cruzi beta-ketoacyl-ACP reductase 0.0013 0.034 0.0339
Toxoplasma gondii redoxin domain-containing protein 0.0037 0.115 0.1341
Echinococcus granulosus carbonic anhydrase 0.0023 0.0695 0.0944
Loa Loa (eye worm) hypothetical protein 0.0009 0.02 0.0218
Plasmodium falciparum carbonic anhydrase 0.0023 0.0695 0.0716
Schistosoma mansoni carbonic anhydrase 0.0023 0.0695 0.0944
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0023 0.0695 0.0944
Trypanosoma brucei protein kinase, putative 0.003 0.0939 0.09
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.0009 0.02 0.0218
Plasmodium falciparum 1-cys peroxiredoxin 0.0037 0.115 0.1252
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0005 0.0087 0.0054
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0023 0.0695 0.0756
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0023 0.0695 0.0944
Entamoeba histolytica recQ family helicase, putative 0.0007 0.014 0.4109
Plasmodium vivax peroxiredoxin, putative 0.0037 0.115 0.1134
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.0255 0.8577 1
Schistosoma mansoni dihydrofolate reductase 0.0205 0.6879 1
Echinococcus multilocularis Ankyrin 0.0009 0.0202 0.0222
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0018 0.0512 0.0598
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0005 0.0087 0.0054
Trypanosoma brucei oxidoreductase-like protein 0.0015 0.0416 0.037
Echinococcus multilocularis carbonic anhydrase 0.0023 0.0695 0.0944
Mycobacterium ulcerans thymidylate synthase 0.0141 0.4705 0.6816
Mycobacterium tuberculosis Probable dehydrogenase/reductase 0.0013 0.034 0.0423
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0013 0.034 0.0423
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0011 0.0288 0.0237
Brugia malayi dihydrofolate reductase family protein 0.0205 0.6879 1
Mycobacterium tuberculosis Probable conserved lipoprotein DsbF 0.0009 0.0226 0.0257
Echinococcus multilocularis carbonic anhydrase 0.0023 0.0695 0.0944
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.003 0.0939 0.1042
Loa Loa (eye worm) hypothetical protein 0.0058 0.1891 0.2695
Loa Loa (eye worm) dihydrofolate reductase 0.0205 0.6879 1
Schistosoma mansoni carbonic anhydrase-related 0.0023 0.0695 0.0944
Toxoplasma gondii 3-ketoacyl-(acyl-carrier-protein) reductase 0.0013 0.034 0.0396
Mycobacterium ulcerans short chain dehydrogenase 0.0013 0.034 0.0423
Echinococcus multilocularis thymidylate synthase 0.0141 0.4705 0.6816
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0007 0.014 0.0104
Onchocerca volvulus 0.0141 0.4698 0.9987
Trichomonas vaginalis peroxiredoxin, putative 0.0009 0.0226 0.0378
Trichomonas vaginalis CMGC family protein kinase 0.003 0.0939 0.1912
Brugia malayi Death domain containing protein 0.0009 0.02 0.0218
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0013 0.034 0.0423
Schistosoma mansoni netrin receptor unc5 0.0009 0.02 0.0218
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.003 0.0939 0.1301
Mycobacterium ulcerans 3-alpha-hydroxysteroid dehydrogenase 0.0015 0.0416 0.0535
Mycobacterium tuberculosis Soluble secreted antigen Mpt53 precursor 0.0009 0.0226 0.0257
Echinococcus granulosus death domain containing protein 0.0009 0.02 0.0218
Trypanosoma cruzi beta-ketoacyl-ACP reductase 0.0013 0.034 0.0339
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0005 0.0087 0.0054
Trichomonas vaginalis hypothetical protein 0.0013 0.034 0.0622
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.003 0.0939 0.09
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0013 0.034 0.0423
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.003 0.0939 0.1042
Loa Loa (eye worm) hypothetical protein 0.0013 0.034 0.0423
Trichomonas vaginalis DNA helicase recq, putative 0.0013 0.034 0.0624
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0023 0.0695 0.0944
Mycobacterium leprae DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE) 0.0205 0.6879 1
Mycobacterium ulcerans short chain dehydrogenase 0.0013 0.034 0.0423
Brugia malayi Dihydrofolate reductase 0.0205 0.6879 1
Echinococcus granulosus netrin receptor unc 5 0.0009 0.02 0.0218
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0005 0.0087 0.0054
Schistosoma mansoni carbonic anhydrase-related 0.0023 0.0695 0.0944
Loa Loa (eye worm) hypothetical protein 0.0023 0.0695 0.0944
Schistosoma mansoni serine/threonine protein kinase 0.003 0.0939 0.1301
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.0255 0.8577 1
Loa Loa (eye worm) thymidylate synthase 0.0141 0.4705 0.6816
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.0009 0.0202 0.0222
Mycobacterium ulcerans thiol peroxidase 0.0009 0.0226 0.0257
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.0255 0.8577 0.8636
Echinococcus multilocularis mitogen activated protein kinase 0.003 0.0939 0.1301
Leishmania major 3-oxoacyl-ACP reductase, putative 0.0013 0.034 0.0291
Mycobacterium ulcerans 3-oxoacyl-ACP reductase 0.0013 0.034 0.0423
Schistosoma mansoni ankyrin 23/unc44 0.0009 0.02 0.0218
Giardia lamblia Kinase, CMGC MAPK 0.003 0.0939 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0695 0.0944
Mycobacterium ulcerans short chain dehydrogenase 0.0013 0.034 0.0423
Onchocerca volvulus 0.0015 0.0416 0.0785
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0008 0.0197 0.023
Echinococcus granulosus bloom syndrome protein 0.0013 0.034 0.0424
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0018 0.0512 0.0676
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.003 0.0939 0.1095
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0005 0.0087 0.0102
Onchocerca volvulus 0.0018 0.0512 0.0992
Loa Loa (eye worm) oxidoreductase 0.0013 0.034 0.0423
Toxoplasma gondii 2,4-dienoyl CoA reductase 2, peroxisomal family protein 0.0015 0.0416 0.0485
Toxoplasma gondii peptidase, M28 family protein 0.0004 0.0051 0.0059
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0015 0.0416 0.0429
Trypanosoma brucei pteridine reductase 1 0.0295 0.9924 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0253 0.0297
Schistosoma mansoni DNA helicase recq1 0.0005 0.0087 0.0054
Schistosoma mansoni DNA helicase recq5 0.0005 0.0087 0.0054
Echinococcus multilocularis n acetylated alpha linked acidic dipeptidase 2 0.0063 0.2032 0.2902
Mycobacterium leprae PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) 0.0141 0.4705 0.6732
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0007 0.014 0.009
Mycobacterium leprae POSSIBLE OXIDOREDUCTASE 0.0013 0.034 0.017
Echinococcus granulosus nuclear factor of activated T cells 5 0.0044 0.1397 0.1972
Mycobacterium ulcerans short chain dehydrogenase 0.0013 0.034 0.0423
Mycobacterium tuberculosis Possible 20-beta-hydroxysteroid dehydrogenase FabG3 (cortisone reductase) ((R)-20-hydroxysteroid dehydrogenase) 0.0013 0.034 0.0423
Brugia malayi Pre-SET motif family protein 0.0124 0.4115 0.5952
Brugia malayi Pre-SET motif family protein 0.0018 0.0512 0.0676
Treponema pallidum thioredoxin 0.0009 0.0226 0.5
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0015 0.0416 0.0535
Schistosoma mansoni dihydropteridine reductase 0.0013 0.034 0.0423
Trichomonas vaginalis set domain proteins, putative 0.0141 0.4696 1
Schistosoma mansoni hypothetical protein 0.0009 0.02 0.0218
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0005 0.0087 0.0102
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0007 0.014 0.0089
Plasmodium vivax SET domain protein, putative 0.0018 0.0512 0.0372
Mycobacterium ulcerans short chain dehydrogenase 0.0013 0.034 0.0423
Mycobacterium ulcerans short chain dehydrogenase 0.0013 0.034 0.0423
Mycobacterium ulcerans short chain dehydrogenase 0.0015 0.0416 0.0535
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0013 0.034 0.0423
Mycobacterium ulcerans short chain dehydrogenase 0.0013 0.034 0.0423
Loa Loa (eye worm) hypothetical protein 0.0005 0.0087 0.0054
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0013 0.034 0.0423
Wolbachia endosymbiont of Brugia malayi enoyl-ACP reductase 0.0013 0.034 0.5
Echinococcus granulosus carbonic anhydrase 0.0023 0.0695 0.0944
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.003 0.0939 0.1042
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.003 0.0939 0.0893
Mycobacterium tuberculosis Probable thiol peroxidase Tpx 0.0009 0.0226 0.0257
Leishmania major carbonic anhydrase-like protein 0.0023 0.0695 0.0648
Echinococcus multilocularis carbonic anhydrase 0.0023 0.0695 0.0944
Brugia malayi Uncoordinated protein 44 0.0009 0.02 0.0218
Schistosoma mansoni bifunctional dihydrofolate reductase-thymidylate synthase 0.0141 0.4705 0.6816
Toxoplasma gondii enoyl-acyl carrier reductase ENR 0.0013 0.034 0.0396
Trichomonas vaginalis DNA helicase recq, putative 0.0007 0.014 0.0191
Mycobacterium leprae 3-OXOACYL-[ACYL-CARRIER PROTEIN] REDUCTASE FABG1 (3-KETOACYL-ACYL CARRIER PROTEIN REDUCTASE) (MYCOLIC ACID BIOSYNTHESIS A PROTEI 0.0013 0.034 0.017
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0023 0.0695 0.0944
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0015 0.0416 0.0535
Onchocerca volvulus 0.0013 0.034 0.0621
Brugia malayi hypothetical protein 0.0067 0.2191 0.3134
Loa Loa (eye worm) hypothetical protein 0.0043 0.1352 0.1906
Plasmodium vivax enoyl-acyl carrier protein reductase 0.0013 0.034 0.0166
Schistosoma mansoni 3-oxoacyl-[ACP] reductase 0.0013 0.034 0.0423
Mycobacterium ulcerans oxidoreductase 0.0013 0.034 0.0423
Mycobacterium ulcerans dihydrofolate reductase DfrA 0.0205 0.6879 1
Trichomonas vaginalis DNA helicase recq1, putative 0.0013 0.034 0.0624
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0013 0.034 0.0423
Trichomonas vaginalis CMGC family protein kinase 0.003 0.0939 0.1912
Echinococcus granulosus histone lysine methyltransferase setb 0.0018 0.0512 0.0676
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0023 0.0695 0.0756
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.0255 0.8577 1
Mycobacterium ulcerans short chain dehydrogenase 0.0013 0.034 0.0423
Leishmania major dehydrogenase/oxidoreductase-like protein 0.0013 0.034 0.0291
Toxoplasma gondii hypothetical protein 0.0023 0.0695 0.0811
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0005 0.0087 0.0054
Leishmania major dehydrogenase/oxidoreductase-like protein 0.0013 0.034 0.0291
Mycobacterium tuberculosis NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) 0.0013 0.034 0.0423
Trypanosoma brucei carbonic anhydrase-like protein 0.0023 0.0695 0.0653
Brugia malayi Bloom's syndrome protein homolog 0.0013 0.034 0.0424
Mycobacterium tuberculosis Probable lipoprotein aminopeptidase LpqL 0.0006 0.0103 0.0076
Onchocerca volvulus Netrin receptor homolog 0.0009 0.02 0.032
Trichomonas vaginalis peroxiredoxin, putative 0.0009 0.0226 0.0378
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0018 0.0512 0.0676
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0013 0.034 0.0423
Schistosoma mansoni NAALADASE L peptidase (M28 family) 0.0041 0.1301 0.1831
Echinococcus multilocularis dihydrofolate reductase 0.0205 0.6879 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0013 0.034 0.0423
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase, putative 0.0067 0.2191 0.251
Plasmodium falciparum 3-oxoacyl-[acyl-carrier-protein] reductase 0.0013 0.034 0.0297
Loa Loa (eye worm) hypothetical protein 0.0064 0.2084 0.2978
Leishmania major biopterin transporter, putative;with=GeneDB:LinJ35_V3.5120 0.0191 0.6379 0.6361
Leishmania major dihydrofolate reductase-thymidylate synthase 0.0255 0.8577 0.857
Trichomonas vaginalis peroxiredoxin, putative 0.0009 0.0226 0.0378
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0023 0.0695 0.0944
Schistosoma mansoni hypothetical protein 0.0023 0.0695 0.0944
Echinococcus granulosus carbonic anhydrase II 0.0023 0.0695 0.0944
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.003 0.0939 0.0893
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.003 0.0939 0.1042
Mycobacterium ulcerans short chain dehydrogenase 0.0013 0.034 0.0423
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0013 0.034 0.0423
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0013 0.034 0.0423
Leishmania major oxidoreductase-like protein 0.0015 0.0416 0.0367
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0013 0.034 0.0423
Echinococcus granulosus thymidylate synthase 0.0141 0.4705 0.6816
Loa Loa (eye worm) hypothetical protein 0.0023 0.0695 0.0944
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0018 0.0512 0.0676
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0023 0.0695 0.0944
Mycobacterium ulcerans short chain dehydrogenase 0.0013 0.034 0.0423
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0013 0.034 0.0423
Toxoplasma gondii short chain dehydrogenase family protein, putative 0.0013 0.034 0.0396
Echinococcus multilocularis bloom syndrome protein 0.0013 0.034 0.0424
Mycobacterium ulcerans 20-beta-hydroxysteroid dehydrogenase FabG3 0.0013 0.034 0.0423
Trichomonas vaginalis conserved hypothetical protein 0.0067 0.2191 0.4607
Loa Loa (eye worm) RecQ helicase 0.0013 0.034 0.0424
Onchocerca volvulus 0.0141 0.4705 1
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0009 0.02 0.0218
Mycobacterium tuberculosis Probable 3-oxoacyl-[acyl-carrier protein] reductase FabG2 (3-ketoacyl-acyl carrier protein reductase) 0.0013 0.034 0.0423
Brugia malayi thymidylate synthase 0.0141 0.4705 0.6816
Echinococcus granulosus dihydrofolate reductase 0.0205 0.6879 1
Mycobacterium tuberculosis Probable thymidylate synthase ThyA (ts) (TSASE) 0.0141 0.4705 0.6816
Brugia malayi Cytochrome P450 family protein 0.0013 0.0366 0.0462
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0023 0.0695 0.0944
Loa Loa (eye worm) hypothetical protein 0.0018 0.0512 0.0676
Mycobacterium ulcerans lipoprotein aminopeptidase LpqL 0.0006 0.0103 0.0076
Plasmodium falciparum enoyl-acyl carrier reductase 0.0013 0.034 0.0297
Plasmodium vivax 3-oxoacyl-[acyl-carrier-protein] reductase, putative 0.0013 0.034 0.0166
Echinococcus multilocularis 3 oxoacyl acyl carrier protein reductase 0.0013 0.034 0.0423
Chlamydia trachomatis dihydrofolate reductase 0.0205 0.6879 1
Schistosoma mansoni blooms syndrome DNA helicase 0.001 0.025 0.0291
Trichomonas vaginalis CMGC family protein kinase 0.003 0.0939 0.1912
Echinococcus granulosus Ankyrin 0.0009 0.0202 0.0222
Trichomonas vaginalis CMGC family protein kinase 0.003 0.0939 0.1912
Trypanosoma brucei beta-ketoacyl-ACP reductase 0.0013 0.034 0.0293
Mycobacterium leprae NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) 0.0013 0.034 0.017
Loa Loa (eye worm) carbonic anhydrase 3 0.0023 0.0695 0.0944
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.0255 0.8577 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0202 0.0222
Echinococcus multilocularis carbonic anhydrase II 0.0023 0.0695 0.0944
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0005 0.0087 0.0054

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 1.7 uM Inhibition of transcription and translation activity in Escherichia coli by luciferase reporter assay ChEMBL. 17590334
IC50 (functional) = 1.7 uM Inhibition of transcription and translation activity in Escherichia coli by luciferase reporter assay ChEMBL. 17590334
MIC (functional) = 0.25 ug ml-1 Antibacterial activity against Streptococcus pneumoniae SV1 SP3 by microbroth method ChEMBL. 17590334
MIC (functional) = 0.5 ug ml-1 Antibacterial activity against Enterococcus faecalis MG2 EF1 by microbroth method ChEMBL. 17590334
MIC (functional) = 1 ug ml-1 Antibacterial activity against Staphylococcus aureus UC76 SA1 by microbroth method ChEMBL. 17590334
MIC (functional) = 2 ug ml-1 Antibacterial activity against Streptococcus pyogenes C203 SP1-1 by microbroth method ChEMBL. 17590334
MIC (functional) = 2 ug ml-1 Antibacterial activity against Moraxella catarrhalis BC3531 by microbroth method ChEMBL. 17590334
MIC (functional) = 4 ug ml-1 Antibacterial activity against Heamophilus influenzae HI3542 by microbroth method ChEMBL. 17590334

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Escherichia coli ChEMBL23 17590334

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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