Detailed information for compound 1388670

Basic information

Technical information
  • TDR Targets ID: 1388670
  • Name: 3-hydroxy-1-methyl-3-(5-phenyl-1,3,4-oxadiazo l-2-yl)indol-2-one
  • MW: 307.303 | Formula: C17H13N3O3
  • H donors: 1 H acceptors: 4 LogP: 1.41 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN1c2ccccc2C(C1=O)(O)c1nnc(o1)c1ccccc1
  • InChi: 1S/C17H13N3O3/c1-20-13-10-6-5-9-12(13)17(22,16(20)21)15-19-18-14(23-15)11-7-3-2-4-8-11/h2-10,22H,1H3
  • InChiKey: ZUFVINSECKEYQX-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-hydroxy-1-methyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)indolin-2-one
  • 3-hydroxy-1-methyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)-2-indolinone
  • 3-hydroxy-1-methyl-3-(5-phenyl-1,3,4-oxadiazol-2-yl)oxindole
  • SMR000343320
  • T0517-3243
  • MLS000517232

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens RAB9A, member RAS oncogene family Starlite/ChEMBL No references
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references
Homo sapiens survival of motor neuron 2, centromeric Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus granulosus survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus multilocularis survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum ras-related protein Rab-5B RAB9A, member RAS oncogene family 201 aa 165 aa 30.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis ap endonuclease, putative 0.002 0.016 0.0644
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0021 0.0179 0.3019
Plasmodium vivax ferrodoxin reductase, putative 0.0006 0.0018 0.0299
Giardia lamblia NADH oxidase lateral transfer candidate 0.0021 0.0179 0.0487
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0021 0.0179 0.3019
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0021 0.0171 0.0465
Entamoeba histolytica exodeoxyribonuclease III, putative 0.002 0.016 0.9368
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.016 0.0436
Echinococcus multilocularis survival motor neuron protein 1 0.0286 0.2887 0.2887
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0006 0.0018 0.0071
Entamoeba histolytica disulphide oxidoreductase, putative 0.0006 0.0018 0.1038
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase family protein 0.0006 0.0018 0.0048
Trypanosoma cruzi NADH dehydrogenase, putative 0.0006 0.0018 0.0299
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0016 0.0121 0.0328
Trichomonas vaginalis DNA helicase recq1, putative 0.0021 0.0171 0.0687
Loa Loa (eye worm) hypothetical protein 0.0363 0.3678 1
Leishmania major NADH dehydrogenase, putative 0.0006 0.0018 0.0299
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0021 0.0179 0.3019
Schistosoma mansoni disulfide oxidoreductase 0.0006 0.0018 0.0299
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0278 0.4689
Brugia malayi glutathione reductase 0.0062 0.0593 0.1613
Trypanosoma brucei trypanothione reductase 0.0062 0.0593 1
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0031 0.0278 0.4689
Trypanosoma brucei pyridine nucleotide-disulphide oxidoreductase, putative 0.0006 0.0018 0.0299
Treponema pallidum ATP-dependent DNA helicase 0.0011 0.0067 0.3758
Trichomonas vaginalis glutamate synthase, putative 0.0006 0.0018 0.0071
Entamoeba histolytica recQ family helicase, putative 0.0021 0.0171 1
Brugia malayi Thioredoxin reductase 0.0062 0.0593 0.1613
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0021 0.0179 0.3019
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.003 0.0266 0.0923
Schistosoma mansoni hypothetical protein 0.0006 0.0018 0.0299
Toxoplasma gondii thioredoxin reductase 0.0062 0.0593 1
Entamoeba histolytica recQ family helicase, putative 0.001 0.0063 0.3695
Loa Loa (eye worm) hypothetical protein 0.0031 0.0278 0.0756
Mycobacterium tuberculosis Probable NADPH:adrenodoxin oxidoreductase FprB (adrenodoxin reductase) (AR) (ferredoxin-NADP(+) reductase) 0.0006 0.0018 0.0299
Brugia malayi Pre-SET motif family protein 0.0031 0.0278 0.0756
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0021 0.0179 0.3019
Echinococcus multilocularis apoptosis inducing factor 1 mitochondrial 0.0006 0.0018 0.0018
Trypanosoma cruzi NADPH:adrenodoxin oxidoreductase, mitochondrial, putative 0.0006 0.0018 0.0299
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0021 0.0171 0.0592
Toxoplasma gondii pyridine nucleotide-disulfide oxidoreductase domain-containing protein 0.0006 0.0018 0.0299
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0021 0.0179 0.3019
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0006 0.0018 0.0071
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0021 0.0179 0.3019
Plasmodium falciparum glutathione reductase 0.0062 0.0593 1
Trypanosoma cruzi pyridine nucleotide-disulphide oxidoreductase, putative 0.0006 0.0018 0.0299
Loa Loa (eye worm) RecQ helicase 0.0021 0.0171 0.0465
Loa Loa (eye worm) hypothetical protein 0.0021 0.0171 0.0465
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.016 0.0436
Schistosoma mansoni hypothetical protein 0.0058 0.0557 0.9385
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0006 0.0018 0.0071
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0021 0.0171 0.2883
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0006 0.0018 0.0071
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0021 0.0171 0.0592
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0006 0.0018 0.0062
Brugia malayi glutamate synthase 0.0006 0.0018 0.0048
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.016 0.2701
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.016 0.016
Toxoplasma gondii pyridine nucleotide-disulfide oxidoreductase domain-containing protein 0.0006 0.0018 0.0299
Trypanosoma brucei hypothetical protein, conserved 0.0006 0.0018 0.0299
Echinococcus granulosus sulfide:quinone oxidoreductase 0.0006 0.0018 0.0062
Toxoplasma gondii exonuclease III APE 0.002 0.016 0.2701
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.016 0.0555
Loa Loa (eye worm) hypothetical protein 0.0286 0.2887 0.785
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0021 0.0171 0.2883
Entamoeba histolytica thioredoxin reductase, putative 0.0006 0.0018 0.1038
Entamoeba histolytica pyridine nucleotide-disulfide oxidoreductase family protein 0.0006 0.0018 0.1038
Trypanosoma cruzi trypanothione reductase, putative 0.0062 0.0593 1
Schistosoma mansoni glutamate synthase 0.0006 0.0018 0.0299
Mycobacterium tuberculosis Probable NADH-dependent glutamate synthase (small subunit) GltD (L-glutamate synthase) (L-glutamate synthetase) (NADH-glutamate 0.0006 0.0018 0.0299
Loa Loa (eye worm) hypothetical protein 0.0363 0.3678 1
Trichomonas vaginalis dihydropyrimidine dehydrogenase, putative 0.0006 0.0018 0.0071
Echinococcus granulosus survival motor neuron protein 1 0.0286 0.2887 1
Giardia lamblia Hypothetical protein 0.0363 0.3678 1
Treponema pallidum oxidoreductase 0.0006 0.0018 0.0992
Trichomonas vaginalis dihydrolipoamide dehydrogenase, putative 0.0006 0.0018 0.0071
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0021 0.0179 1
Echinococcus granulosus NADPH:adrenodoxin oxidoreductase 0.0006 0.0018 0.0062
Plasmodium vivax ATP-dependent DNA helicase Q1, putative 0.001 0.0063 0.1065
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0021 0.0179 0.3019
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0021 0.0179 0.0487
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0006 0.0018 0.0299
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0021 0.0179 1
Schistosoma mansoni survival motor neuron protein 0.0058 0.0557 0.9385
Loa Loa (eye worm) pyridine nucleotide-disufhide oxidoreductase 0.0006 0.0018 0.0048
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0031 0.0278 0.4689
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0021 0.0179 1
Loa Loa (eye worm) thioredoxin reductase 0.0062 0.0593 0.1613
Brugia malayi Fibroblast growth factor family protein 0.0363 0.3678 1
Plasmodium vivax SET domain protein, putative 0.0031 0.0278 0.4689
Brugia malayi Fibroblast growth factor family protein 0.0363 0.3678 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0278 0.4689
Onchocerca volvulus 0.0031 0.0278 0.1118
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0021 0.0179 0.3019
Trypanosoma cruzi hypothetical protein, conserved 0.0006 0.0018 0.0299
Trichomonas vaginalis DNA helicase recq, putative 0.0021 0.0171 0.0687
Trypanosoma cruzi trypanothione reductase, putative 0.0021 0.0179 0.3019
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0006 0.0018 0.0299
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0006 0.0018 0.0062
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.016 0.2701
Plasmodium falciparum thioredoxin reductase 0.0062 0.0593 1
Trichomonas vaginalis apoptosis inducing factor, putative 0.0006 0.0018 0.0071
Onchocerca volvulus 0.0247 0.2488 1
Leishmania major trypanothione reductase 0.0062 0.0593 1
Brugia malayi NADPH:adrenodoxin oxidoreductase, mitochondrial precursor 0.0006 0.0018 0.0048
Toxoplasma gondii selenide, water dikinase 0.0006 0.0018 0.0299
Plasmodium vivax glutathione reductase, putative 0.0062 0.0593 1
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0021 0.0171 0.2883
Trypanosoma brucei NADH dehydrogenase 0.0006 0.0018 0.0299
Schistosoma mansoni ap endonuclease 0.002 0.016 0.2701
Brugia malayi Bloom's syndrome protein homolog 0.0021 0.0171 0.0465
Toxoplasma gondii NADPH-glutathione reductase 0.0021 0.0179 0.3019
Mycobacterium tuberculosis Probable reductase 0.0006 0.0018 0.0299
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase family protein 0.0006 0.0018 0.0048
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.002 0.016 0.0436
Leishmania major 2,4-dienoyl-coa reductase fadh1, putative 0.0006 0.0018 0.0299
Schistosoma mansoni ap endonuclease 0.002 0.016 0.2701
Leishmania major hypothetical protein, conserved 0.0006 0.0018 0.0299
Mycobacterium tuberculosis Probable thioredoxin reductase TrxB2 (TRXR) (TR) 0.0006 0.0018 0.0299
Mycobacterium tuberculosis NADPH:adrenodoxin oxidoreductase FprA (NADPH-ferredoxin reductase) 0.0006 0.0018 0.0299
Trichomonas vaginalis glutamate synthase, putative 0.0006 0.0018 0.0071
Plasmodium falciparum glutathione reductase 0.0021 0.0179 0.3019
Schistosoma mansoni glutamate synthase 0.0006 0.0018 0.0299
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0062 0.0593 1
Trypanosoma cruzi 2,4-dienoyl-coa reductase fadh1, putative 0.0006 0.0018 0.0299
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0021 0.0179 0.3019
Entamoeba histolytica glutamate synthase beta subunit, putative 0.0006 0.0018 0.1038
Trypanosoma brucei pyridine nucleotide-disulphide oxidoreductase, putative 0.0006 0.0018 0.0299
Plasmodium falciparum ferrodoxin reductase-like protein 0.0006 0.0018 0.0299
Schistosoma mansoni sulfide quinone reductase 0.0006 0.0018 0.0299
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0006 0.0018 0.0018
Trypanosoma cruzi pyridine nucleotide-disulphide oxidoreductase, putative 0.0006 0.0018 0.0299
Trypanosoma cruzi 2,4-dienoyl-coa reductase-like protein, putative 0.0006 0.0018 0.0299
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.016 0.8947
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0217 0.2181 0.5929
Leishmania major hypothetical protein, conserved 0.0006 0.0018 0.0299
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0278 0.4689
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0021 0.0171 0.0171
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0021 0.0179 0.3019
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0021 0.0179 1
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.001 0.0063 0.1065
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0021 0.0179 1
Schistosoma mansoni blooms syndrome DNA helicase 0.0011 0.0067 0.1135
Echinococcus granulosus histone lysine methyltransferase setb 0.0031 0.0278 0.0963
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.016 0.2701
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0021 0.0179 0.3019
Trypanosoma brucei 2,4-dienoyl-coa reductase-like protein 0.0006 0.0018 0.0299
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0021 0.0179 0.3019
Loa Loa (eye worm) glutathione reductase 0.0062 0.0593 0.1613
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0011 0.0067 0.1135
Leishmania major 2,4-dienoyl-coa reductase-like protein 0.0006 0.0018 0.0299
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0021 0.0179 0.062
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0021 0.0171 0.2883
Trypanosoma cruzi NADH dehydrogenase, putative 0.0006 0.0018 0.0299
Echinococcus multilocularis pyridine nucleotide disulfide oxidoreductase 0.0006 0.0018 0.0018
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0021 0.0171 0.0465
Trichomonas vaginalis set domain proteins, putative 0.0247 0.2488 1
Trichomonas vaginalis ap endonuclease, putative 0.002 0.016 0.0644
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.002 0.016 0.2701
Mycobacterium tuberculosis Probable NADPH dependent 2,4-dienoyl-CoA reductase FadH (2,4-dienoyl coenzyme A reductase) (4-enoyl-CoA reductase) 0.0006 0.0018 0.0299
Entamoeba histolytica dihydropyrimidine dehydrogenase, putative 0.0006 0.0018 0.1038
Giardia lamblia Thioredoxin reductase 0.0006 0.0018 0.0048
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0021 0.0179 0.3019
Loa Loa (eye worm) hypothetical protein 0.0011 0.0067 0.0183
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0006 0.0018 0.0071
Leishmania major hypothetical protein, conserved 0.0006 0.0018 0.0299
Echinococcus granulosus pyridine nucleotide disulfide oxidoreductase 0.0006 0.0018 0.0062
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0021 0.0179 0.3019
Loa Loa (eye worm) hypothetical protein 0.0011 0.0067 0.0183
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0021 0.0179 0.3019
Echinococcus granulosus glutamate synthase 0.0006 0.0018 0.0062
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0006 0.0018 0.0071
Trypanosoma cruzi hypothetical protein, conserved 0.0006 0.0018 0.0299
Mycobacterium tuberculosis Possible dehydrogenase/reductase 0.0006 0.0018 0.0299
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0021 0.0171 0.2883
Echinococcus multilocularis sulfide:quinone oxidoreductase 0.0006 0.0018 0.0018
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0006 0.0018 0.0018
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0021 0.0171 0.0171
Brugia malayi Pre-SET motif family protein 0.0217 0.2181 0.5929
Entamoeba histolytica glutamate synthase beta subunit, putative 0.0006 0.0018 0.1038
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0021 0.0179 0.3019
Trichomonas vaginalis mercuric reductase, putative 0.0021 0.0179 0.072
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0058 0.0557 0.1513
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0021 0.0179 0.3019
Toxoplasma gondii non-proton pumping type-II NADH dehydrogenase I 0.0006 0.0018 0.0299
Echinococcus granulosus thioredoxin glutathione reductase 0.0062 0.0593 0.2054
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0021 0.0171 0.2883
Loa Loa (eye worm) hypothetical protein 0.0129 0.1283 0.3488
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0021 0.0179 1
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.002 0.016 0.8832
Brugia malayi Protein kinase domain containing protein 0.0129 0.1283 0.3488
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.016 0.2701
Trichomonas vaginalis glutathione reductase, putative 0.0021 0.0179 0.072
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0021 0.0179 0.3019
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0021 0.0179 0.3019
Plasmodium falciparum type II NADH:ubiquinone oxidoreductase 0.0006 0.0018 0.0299
Echinococcus granulosus apoptosis inducing factor 1 mitochondrial 0.0006 0.0018 0.0062
Echinococcus multilocularis thioredoxin glutathione reductase 0.0062 0.0593 0.0593
Loa Loa (eye worm) programmed cell death 8 0.0006 0.0018 0.0048
Entamoeba histolytica recQ family DNA helicase 0.0011 0.0067 0.3935
Trichomonas vaginalis DNA helicase recq, putative 0.0021 0.0171 0.0687
Loa Loa (eye worm) hypothetical protein 0.0006 0.0018 0.0048
Giardia lamblia Glycerol-3-phosphate dehydrogenase 0.0006 0.0018 0.0048
Echinococcus granulosus bloom syndrome protein 0.0021 0.0171 0.0592
Schistosoma mansoni DNA helicase recq1 0.0021 0.0171 0.2883
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.016 0.2701
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.016 0.2701
Schistosoma mansoni sulfide quinone reductase 0.0006 0.0018 0.0299
Echinococcus multilocularis glutamate synthase 0.0006 0.0018 0.0018
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0016 0.0121 0.0328
Plasmodium falciparum thioredoxin reductase 0.0021 0.0179 0.3019
Toxoplasma gondii NADH dehydrogenase (NDH2-II) 0.0006 0.0018 0.0299
Mycobacterium tuberculosis Probable oxidoreductase 0.0021 0.0179 0.3019
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0021 0.0179 0.0179
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0006 0.0018 0.0071
Plasmodium falciparum NAD(P)H-dependent glutamate synthase, putative 0.0006 0.0018 0.0299
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0031 0.0278 0.0278
Treponema pallidum NADH oxidase 0.0021 0.0179 1
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0021 0.0179 0.3019
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0011 0.0067 0.1135
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0006 0.0018 0.0299
Echinococcus multilocularis bloom syndrome protein 0.0021 0.0171 0.0171
Echinococcus multilocularis NADPH:adrenodoxin oxidoreductase 0.0006 0.0018 0.0018
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0021 0.0179 0.3019
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0031 0.0278 0.0278
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0011 0.0067 0.1135
Schistosoma mansoni glutamate synthase 0.0006 0.0018 0.0299
Trypanosoma brucei NADPH:adrenodoxin oxidoreductase, mitochondrial, putative 0.0006 0.0018 0.0299
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0021 0.0179 1
Onchocerca volvulus 0.0058 0.0557 0.2238
Entamoeba histolytica NAD(FAD)-dependent dehydrogenase, putative 0.0006 0.0018 0.1038
Schistosoma mansoni blooms syndrome DNA helicase 0.001 0.0063 0.1065
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0021 0.0179 0.3019
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.016 0.8832
Onchocerca volvulus 0.0006 0.0018 0.0071
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0021 0.0171 0.0465
Schistosoma mansoni DNA helicase recq5 0.0021 0.0171 0.2883
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0021 0.0171 0.2883
Giardia lamblia Glutamate synthase 0.0006 0.0018 0.0048
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0006 0.0018 0.0299
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0021 0.0179 0.3019
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0006 0.0018 0.0071
Plasmodium vivax type II NADH:ubiquinone oxidoreductase, putative 0.0006 0.0018 0.0299
Plasmodium vivax thioredoxin reductase, putative 0.0062 0.0593 1
Brugia malayi hypothetical protein 0.0286 0.2887 0.785
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0021 0.0179 0.3019
Treponema pallidum thioredoxin reductase (trxB) 0.0006 0.0018 0.0992
Toxoplasma gondii pyridine nucleotide-disulfide oxidoreductase domain-containing protein 0.0006 0.0018 0.0299
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0011 0.0067 0.1135
Plasmodium vivax NAD(P)H-dependent glutamate synthase, putative 0.0006 0.0018 0.0299
Giardia lamblia Sgs1 DNA helicase, putative 0.0021 0.0171 0.0465
Mycobacterium tuberculosis Probable dehydrogenase 0.0006 0.0018 0.0299

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.4654 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 3.5481 um PUBCHEM_BIOASSAY: qHTS Assay for Rab9 Promoter Activators. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 17.7828 um PUBCHEM_BIOASSAY: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.3489 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 29.081 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that induce genotoxicity in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493106, AID493143] ChEMBL. No reference
Potency (functional) 29.0929 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS Assay to Identify Small Molecule Activators of BRCA1 Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 63.0957 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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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