Detailed information for compound 544408

Basic information

Technical information
  • TDR Targets ID: 544408
  • Name: 9-(isopropylideneamino)-2,2-dimethyl-1H-purin e-6-carboxamide
  • MW: 248.284 | Formula: C11H16N6O
  • H donors: 2 H acceptors: 1 LogP: -0.68 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=Nn1cnc2=C(NC(N=c12)(C)C)C(=O)N)C
  • InChi: 1S/C11H16N6O/c1-6(2)16-17-5-13-8-7(9(12)18)14-11(3,4)15-10(8)17/h5,14H,1-4H3,(H2,12,18)
  • InChiKey: QXPJQTLTGSMSQN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2,2-dimethyl-9-(propan-2-ylideneamino)-1H-purine-6-carboxamide
  • NCI60_020962
  • 2,2-Dimethyl-9-((1-methylethylidene)amino)-2,9-dihydro-1H-purine-6-carboxamide
  • AIDS-142298
  • AIDS142298
  • NSC659337

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
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0049 0.09 0.1197
Echinococcus multilocularis NADPH:adrenodoxin oxidoreductase 0.0013 0.0092 0.0099
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0066 0.1278 0.24
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0054 0.1007 0.1355
Loa Loa (eye worm) hypothetical protein 0.0071 0.1397 0.2624
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0049 0.09 0.2803
Treponema pallidum NADH oxidase 0.0049 0.09 1
Trypanosoma cruzi trypanothione reductase, putative 0.0142 0.2974 0.4269
Echinococcus granulosus cpg binding protein 0.0031 0.0491 0.0537
Mycobacterium tuberculosis Probable lipase LipE 0.0071 0.1397 0.1317
Echinococcus multilocularis dnaJ subfamily B 0.0415 0.9109 1
Schistosoma mansoni alpha-glucosidase 0.0142 0.2977 0.2934
Loa Loa (eye worm) pyridine nucleotide-disufhide oxidoreductase 0.0013 0.0092 0.0169
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0037 0.0619 1
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0359 0.7849 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0071 0.1397 0.2624
Mycobacterium tuberculosis Conserved hypothetical protein 0.0165 0.351 0.345
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase family protein 0.0013 0.0092 0.0174
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0454 0.085
Loa Loa (eye worm) hypothetical protein 0.0071 0.1397 0.2624
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0149 0.3134 0.4505
Echinococcus multilocularis pyridine nucleotide disulfide oxidoreductase 0.0013 0.0092 0.0099
Echinococcus multilocularis neutral alpha glucosidase AB 0.0037 0.0619 0.0677
Brugia malayi Glycosyl hydrolases family 31 protein 0.0037 0.0619 0.1165
Trichomonas vaginalis maltase-glucoamylase, putative 0.0014 0.0105 0.01
Trichomonas vaginalis alpha-glucosidase, putative 0.0014 0.0105 0.01
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0044 0.0791 0.1034
Onchocerca volvulus 0.0029 0.0454 0.1963
Mycobacterium ulcerans esterase/lipase LipP 0.0071 0.1397 0.3816
Loa Loa (eye worm) inositol-1 0.0036 0.0615 0.1152
Mycobacterium tuberculosis Probable lipase LipD 0.0071 0.1397 0.1317
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0099 0.2014 0.2209
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0099 0.2014 0.2209
Trichomonas vaginalis inositol monophosphatase, putative 0.0036 0.0615 0.4004
Plasmodium falciparum thioredoxin reductase 0.0049 0.09 0.2803
Onchocerca volvulus 0.0071 0.1397 0.7081
Echinococcus multilocularis survival motor neuron protein 1 0.0246 0.5315 0.5834
Trichomonas vaginalis mercuric reductase, putative 0.0049 0.09 0.6194
Brugia malayi glutathione reductase 0.0142 0.2974 0.5596
Loa Loa (eye worm) programmed cell death 8 0.0013 0.0092 0.0169
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0049 0.09 0.1197
Trypanosoma brucei trypanothione reductase 0.0142 0.2974 0.4269
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0619 0.4039
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0619 0.4039
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase family protein 0.0013 0.0092 0.0174
Trichomonas vaginalis alpha-glucosidase, putative 0.0014 0.0105 0.01
Echinococcus multilocularis apoptosis inducing factor 1 mitochondrial 0.0013 0.0092 0.0099
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0049 0.09 0.1197
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0036 0.0608 0.1144
Giardia lamblia NADH oxidase lateral transfer candidate 0.0049 0.09 1
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0036 0.0615 0.4004
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0323 0.7041 0.7013
Trichomonas vaginalis penicillin-binding protein, putative 0.0071 0.1397 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0099 0.2014 0.1955
Brugia malayi RNA binding protein 0.0066 0.1278 0.2404
Schistosoma mansoni hypothetical protein 0.005 0.0925 0.0847
Trichomonas vaginalis D-aminoacylase, putative 0.0071 0.1397 1
Loa Loa (eye worm) hypothetical protein 0.0071 0.1397 0.2624
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0071 0.1397 0.2628
Echinococcus granulosus lysosomal alpha glucosidase 0.0165 0.349 0.383
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0619 0.4039
Mycobacterium tuberculosis Probable oxidoreductase 0.0359 0.7849 0.7829
Leishmania major trypanothione reductase 0.0142 0.2974 0.4269
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0619 0.078
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0049 0.09 0.2803
Mycobacterium tuberculosis Conserved protein 0.0071 0.1397 0.1317
Trypanosoma cruzi trypanothione reductase, putative 0.0049 0.09 0.1197
Echinococcus granulosus sulfide:quinone oxidoreductase 0.0013 0.0092 0.0099
Plasmodium falciparum glutathione reductase 0.0049 0.09 0.2803
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0049 0.09 0.1197
Brugia malayi Inositol-1 0.0036 0.0615 0.1156
Mycobacterium leprae conserved hypothetical protein 0.0071 0.1397 0.1682
Mycobacterium ulcerans beta-lactamase 0.0071 0.1397 0.3816
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0036 0.0615 0.4004
Mycobacterium tuberculosis Conserved protein 0.0071 0.1397 0.1317
Schistosoma mansoni inositol monophosphatase 0.0036 0.0615 0.0531
Echinococcus multilocularis sulfide:quinone oxidoreductase 0.0013 0.0092 0.0099
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0099 0.2014 0.3786
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0037 0.0619 0.4039
Echinococcus granulosus NADPH:adrenodoxin oxidoreductase 0.0013 0.0092 0.0099
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0044 0.0791 0.1034
Trichomonas vaginalis sucrase-isomaltase, putative 0.0037 0.0619 0.4039
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0037 0.0619 0.1161
Loa Loa (eye worm) hypothetical protein 0.0071 0.1397 0.2624
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0099 0.2014 0.2209
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0049 0.09 0.1197
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0071 0.1397 0.1327
Brugia malayi NADPH:adrenodoxin oxidoreductase, mitochondrial precursor 0.0013 0.0092 0.0174
Trypanosoma brucei hypothetical protein, conserved 0.0071 0.1397 0.1932
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0149 0.3134 0.4505
Mycobacterium tuberculosis Probable reductase 0.0323 0.7041 0.7013
Brugia malayi beta-lactamase family protein 0.0071 0.1397 0.2628
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0314 0.6844 1
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0049 0.09 0.2364
Mycobacterium ulcerans lipase LipD 0.0071 0.1397 0.3816
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0049 0.09 0.2364
Loa Loa (eye worm) hypothetical protein 0.0246 0.5315 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0071 0.1397 0.1327
Echinococcus multilocularis beta LACTamase domain containing family member 0.0071 0.1397 0.1531
Plasmodium falciparum glutathione reductase 0.0142 0.2974 1
Leishmania major mitochondrial DNA polymerase beta 0.0314 0.6844 1
Loa Loa (eye worm) transcription factor SMAD2 0.0119 0.2466 0.4637
Toxoplasma gondii thioredoxin reductase 0.0142 0.2974 1
Schistosoma mansoni tar DNA-binding protein 0.0066 0.1278 0.1206
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0049 0.09 0.0815
Mycobacterium ulcerans hypothetical protein 0.0165 0.351 1
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0049 0.09 0.1197
Echinococcus granulosus survival motor neuron protein 1 0.0246 0.5315 0.5834
Plasmodium falciparum thioredoxin reductase 0.0142 0.2974 1
Toxoplasma gondii hypothetical protein 0.0051 0.0936 0.2929
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0071 0.1397 0.1317
Leishmania major glycosyl hydrolase-like protein 0.0014 0.0105 0.0019
Loa Loa (eye worm) hypothetical protein 0.0071 0.1397 0.2624
Echinococcus granulosus apoptosis inducing factor 1 mitochondrial 0.0013 0.0092 0.0099
Trichomonas vaginalis esterase, putative 0.0071 0.1397 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0119 0.2466 0.4637
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0615 0.0774
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0049 0.09 0.1197
Echinococcus granulosus pyridine nucleotide disulfide oxidoreductase 0.0013 0.0092 0.0099
Schistosoma mansoni alpha glucosidase 0.0037 0.0619 0.0536
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0619 0.078
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0323 0.7041 0.7013
Echinococcus granulosus tar DNA binding protein 0.0066 0.1278 0.14
Echinococcus multilocularis glutamate synthase 0.0013 0.0092 0.0099
Trichomonas vaginalis maltase-glucoamylase, putative 0.0037 0.0619 0.4039
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0037 0.0619 0.1828
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0013 0.0092 0.0099
Mycobacterium leprae Probable lipase LipE 0.0071 0.1397 0.1682
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0036 0.0615 0.6464
Trypanosoma brucei glucosidase, putative 0.0037 0.0619 0.078
Toxoplasma gondii NADPH-glutathione reductase 0.0049 0.09 0.2803
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0049 0.09 0.0986
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0049 0.09 0.2803
Toxoplasma gondii ABC1 family protein 0.0071 0.1397 0.4526
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0014 0.0105 0.0019
Brugia malayi CXXC zinc finger family protein 0.0029 0.0454 0.0854
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0142 0.2974 0.2909
Onchocerca volvulus Uncharacterized family 31 glucosidase KIAA1161 homolog 0.0014 0.0105 0.0071
Brugia malayi Glycosyl hydrolases family 31 protein 0.0014 0.0105 0.0198
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0619 0.4039
Mycobacterium ulcerans hypothetical protein 0.0071 0.1397 0.3816
Trichomonas vaginalis alpha-glucosidase, putative 0.0014 0.0105 0.01
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0071 0.1397 0.3816
Brugia malayi beta-lactamase family protein 0.0071 0.1397 0.2628
Schistosoma mansoni tar DNA-binding protein 0.0066 0.1278 0.1206
Mycobacterium tuberculosis Probable esterase LipL 0.0071 0.1397 0.1317
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0165 0.349 0.6565
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0323 0.7041 0.7013
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0033 0.0529 0.0563
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0615 0.0774
Leishmania major alpha glucosidase II subunit, putative 0.0037 0.0619 0.078
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0014 0.0105 0.01
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0071 0.1397 0.1317
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0071 0.1397 0.1317
Trichomonas vaginalis glutathione reductase, putative 0.0049 0.09 0.6194
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0049 0.09 0.1197
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0062 0.1187 0.1113
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0049 0.09 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0619 0.4039
Schistosoma mansoni alpha-glucosidase 0.0142 0.2977 0.2934
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0033 0.0529 0.0441
Schistosoma mansoni tar DNA-binding protein 0.0066 0.1278 0.1206
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0049 0.09 1
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0044 0.0791 0.1034
Loa Loa (eye worm) hypothetical protein 0.0071 0.1397 0.2624
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0049 0.09 0.1694
Trypanosoma brucei glycosyl hydrolase-like protein 0.0014 0.0105 0.0019
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0014 0.0105 0.0247
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0323 0.7041 0.8958
Echinococcus granulosus beta LACTamase domain containing family member 0.0071 0.1397 0.1531
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0049 0.09 0.1197
Onchocerca volvulus 0.005 0.0925 0.4521
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0049 0.09 1
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.005 0.0925 0.1741
Echinococcus granulosus neutral alpha glucosidase AB 0.0037 0.0619 0.0677
Loa Loa (eye worm) TAR-binding protein 0.0066 0.1278 0.24
Brugia malayi Thioredoxin reductase 0.0142 0.2974 0.5596
Echinococcus multilocularis lysosomal alpha glucosidase 0.0165 0.349 0.383
Trichomonas vaginalis D-aminoacylase, putative 0.0071 0.1397 1
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0049 0.09 0.1197
Plasmodium vivax thioredoxin reductase, putative 0.0142 0.2974 1
Trichomonas vaginalis D-aminoacylase, putative 0.0071 0.1397 1
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0036 0.0615 0.1528
Loa Loa (eye worm) beta-lactamase 0.0071 0.1397 0.2624
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0014 0.0105 0.0019
Brugia malayi RNA recognition motif domain containing protein 0.0066 0.1278 0.2404
Brugia malayi beta-lactamase 0.0071 0.1397 0.2628
Onchocerca volvulus 0.0095 0.1935 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0099 0.2014 0.3789
Leishmania major hypothetical protein, conserved 0.0071 0.1397 0.1932
Schistosoma mansoni cpg binding protein 0.0031 0.0491 0.0406
Echinococcus multilocularis cpg binding protein 0.0031 0.0491 0.0537
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0013 0.0092 0.0099
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0013 0.0092 0.0099
Loa Loa (eye worm) thioredoxin reductase 0.0142 0.2974 0.5594
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0314 0.6844 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0099 0.2014 0.1955
Onchocerca volvulus 0.0071 0.1397 0.7081
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0615 0.0774
Schistosoma mansoni tar DNA-binding protein 0.0066 0.1278 0.1206
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0049 0.09 0.0822
Echinococcus granulosus inositol monophosphatase 1 0.0036 0.0615 0.0672
Schistosoma mansoni survival motor neuron protein 0.005 0.0925 0.0847
Echinococcus multilocularis thioredoxin glutathione reductase 0.0142 0.2974 0.3263
Schistosoma mansoni cpg binding protein 0.0031 0.0491 0.0406
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0049 0.09 0.1197
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0615 0.0774
Loa Loa (eye worm) hypothetical protein 0.0013 0.0092 0.0169
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0359 0.7849 0.7829
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0099 0.2014 0.2209
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0149 0.3134 0.4505
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0036 0.0615 0.9913
Plasmodium vivax glutathione reductase, putative 0.0142 0.2974 1
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0314 0.6844 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0323 0.7041 0.7013
Trichomonas vaginalis alpha-glucosidase, putative 0.0014 0.0105 0.01
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0036 0.0608 0.1144
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0049 0.09 0.2803
Echinococcus multilocularis tar DNA binding protein 0.0066 0.1278 0.14
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0044 0.0791 0.1034
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0049 0.09 0.2803
Trichomonas vaginalis penicillin-binding protein, putative 0.0071 0.1397 1
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0036 0.0615 0.1812
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0049 0.09 0.1197
Schistosoma mansoni cpg binding protein 0.0029 0.0454 0.0368
Loa Loa (eye worm) hypothetical protein 0.0014 0.0105 0.0193
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0049 0.09 0.1197
Schistosoma mansoni inositol monophosphatase 0.0036 0.0615 0.0531
Echinococcus multilocularis lysosomal alpha glucosidase 0.0165 0.349 0.383
Onchocerca volvulus 0.0071 0.1397 0.7081
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0037 0.0619 1
Mycobacterium tuberculosis Conserved protein 0.0071 0.1397 0.1317
Brugia malayi glutamate synthase 0.0013 0.0092 0.0174
Mycobacterium tuberculosis Probable hydrolase 0.0071 0.1397 0.1317
Trypanosoma cruzi hypothetical protein, conserved 0.0071 0.1397 0.1932
Brugia malayi TAR-binding protein 0.0066 0.1278 0.2404
Brugia malayi Glycosyl hydrolases family 31 protein 0.0165 0.349 0.6567
Echinococcus granulosus dnaJ subfamily B 0.0415 0.9109 1
Echinococcus multilocularis inositol monophosphatase 1 0.0036 0.0615 0.0672
Mycobacterium tuberculosis Probable dehydrogenase 0.0323 0.7041 0.7013
Loa Loa (eye worm) RNA binding protein 0.0066 0.1278 0.24
Trichomonas vaginalis alpha-glucosidase, putative 0.0014 0.0105 0.01
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.1039 0.3283
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0049 0.09 0.0986
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0014 0.0105 0.01
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0013 0.0092 0.0099
Loa Loa (eye worm) glutathione reductase 0.0142 0.2974 0.5594
Echinococcus granulosus glutamate synthase 0.0013 0.0092 0.0099
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0049 0.09 0.2364
Brugia malayi MH2 domain containing protein 0.0119 0.2466 0.4639
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0049 0.09 0.1197
Plasmodium vivax hypothetical protein, conserved 0.0071 0.1397 0.4526
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0049 0.09 0.1197
Schistosoma mansoni tar DNA-binding protein 0.0066 0.1278 0.1206
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0037 0.0619 0.4039
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0049 0.09 0.1197
Schistosoma mansoni hypothetical protein 0.0415 0.9109 0.9172
Trypanosoma cruzi hypothetical protein, conserved 0.0071 0.1397 0.1932
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0099 0.2014 0.1955
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0359 0.7849 0.7829
Echinococcus granulosus thioredoxin glutathione reductase 0.0142 0.2974 0.3263
Brugia malayi hypothetical protein 0.0246 0.5315 1

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -5 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -5 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) 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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