Detailed information for compound 322564

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 246.154 | Formula: C9H11O6P
  • H donors: 3 H acceptors: 5 LogP: -0.37 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)Cc1ccc(cc1)OCP(=O)(O)O
  • InChi: 1S/C9H11O6P/c10-9(11)5-7-1-3-8(4-2-7)15-6-16(12,13)14/h1-4H,5-6H2,(H,10,11)(H2,12,13,14)
  • InChiKey: MXICLCTVVFMUPA-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

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
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0017 0.0025 0.0015
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0089 0.0064
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0125 0.0637 0.0628
Echinococcus granulosus beta LACTamase domain containing family member 0.004 0.0158 0.0158
Loa Loa (eye worm) CXXC zinc finger family protein 0.0032 0.0109 0.01
Echinococcus multilocularis uracil DNA glycosylase 0.0074 0.035 0.035
Onchocerca volvulus 0.0123 0.0624 0.081
Leishmania major polyprenyl synthase, putative 0.176 0.9932 0.9932
Schistosoma mansoni cytochrome P450 0.0014 0.001 0.001
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0198 0.0198
Mycobacterium ulcerans error-prone DNA polymerase 0.1121 0.6296 0.6293
Giardia lamblia Farnesyl diphosphate synthase 0.1772 1 1
Plasmodium falciparum glutathione reductase 0.0049 0.0207 0.0183
Loa Loa (eye worm) hypothetical protein 0.0056 0.0244 0.0234
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0017 0.0025 0.0015
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0112 0.0566 0.0556
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.0025 0.0015
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0112 0.0566 0.088
Brugia malayi Hexokinase family protein 0.0077 0.0365 0.0355
Entamoeba histolytica bifunctional short chain isoprenyl diphosphate synthase, putative 0.0704 0.3928 0.6006
Mycobacterium ulcerans esterase/lipase LipP 0.004 0.0158 0.0148
Trypanosoma cruzi trypanothione reductase, putative 0.0017 0.0025 0.0015
Plasmodium vivax hexokinase, putative 0.0123 0.0624 0.0601
Echinococcus multilocularis hexokinase type 2 0.0123 0.0624 0.0624
Brugia malayi glutathione reductase 0.0049 0.0207 0.0198
Echinococcus granulosus hexokinase type 2 0.0123 0.0624 0.0624
Trypanosoma cruzi polyprenyl synthase, putative 0.176 0.9932 0.9932
Echinococcus granulosus tumor protein p63 0.038 0.2087 0.2087
Mycobacterium leprae Probable lipase LipE 0.004 0.0158 0.0234
Mycobacterium tuberculosis Probable uracil-DNA glycosylase Ung (UDG) 0.0043 0.017 0.016
Toxoplasma gondii DNA topoisomerase family protein 0.0651 0.3626 0.362
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0158 0.0133
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0158 0.0158
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0112 0.0566 0.0556
Onchocerca volvulus 0.004 0.0158 0.0076
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0017 0.0025 0.0015
Trypanosoma cruzi DNA topoisomerase III, putative 0.1151 0.6468 0.6465
Entamoeba histolytica hexokinase 1 0.0123 0.0624 0.0811
Chlamydia trachomatis uracil DNA glycosylase 0.0074 0.035 0.0519
Brugia malayi DNA topoisomerase II, alpha isozyme 0.0283 0.1538 0.153
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0017 0.0025 0.0015
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0198 0.0198
Mycobacterium ulcerans DNA gyrase subunit B 0.0283 0.1538 0.153
Leishmania major trypanothione reductase 0.0049 0.0207 0.0198
Leishmania major hexokinase, putative 0.0123 0.0624 0.0615
Mycobacterium leprae PROBABLE DNA POLYMERASE III (ALPHA CHAIN) DNAE1 (DNA NUCLEOTIDYLTRANSFERASE) 0.1126 0.6329 1
Loa Loa (eye worm) hypothetical protein 0.0263 0.1422 0.1413
Wolbachia endosymbiont of Brugia malayi DNA polymerase III alpha subunit 0.1121 0.6296 1
Treponema pallidum DNA gyrase, subunit B (gyrB) 0.0283 0.1538 0.1527
Onchocerca volvulus 0.0123 0.0624 0.081
Entamoeba histolytica hypothetical protein 0.0037 0.0141 0.0051
Plasmodium vivax geranylgeranyl pyrophosphate synthase 0.1772 1 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0112 0.0566 0.0556
Brugia malayi beta-lactamase 0.004 0.0158 0.0148
Entamoeba histolytica DNA topoisomerase III, putative 0.0651 0.3626 0.5531
Loa Loa (eye worm) TOPoisomerase family member 0.0283 0.1538 0.153
Trichomonas vaginalis prokaryotic DNA topoisomerase, putative 0.0651 0.3626 0.361
Loa Loa (eye worm) glutathione reductase 0.0049 0.0207 0.0198
Echinococcus multilocularis beta LACTamase domain containing family member 0.004 0.0158 0.0158
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0141 0.0141
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.0198 0.0189
Trypanosoma brucei hexokinase 0.0123 0.0624 0.0615
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0141 0.0141
Mycobacterium ulcerans geranylgeranyl pyrophosphate synthase 0.1772 1 1
Echinococcus multilocularis geranylgeranyl pyrophosphate synthase 0.176 0.9932 0.9932
Schistosoma mansoni farnesyl pyrophosphate synthase 0.1772 1 1
Echinococcus multilocularis DNA topoisomerase 3 beta 1 0.1151 0.6468 0.6468
Trichomonas vaginalis uracil DNA glycosylase, putative 0.0074 0.035 0.0326
Treponema pallidum DNA polymerase 0.0032 0.0108 0.0084
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.004 0.0158 0.0148
Trypanosoma brucei DNA topoisomerase ii 0.0283 0.1538 0.153
Schistosoma mansoni cpg binding protein 0.0034 0.012 0.012
Brugia malayi DNA gyrase/topoisomerase IV, A subunit family protein 0.0283 0.1538 0.153
Loa Loa (eye worm) hypothetical protein 0.0084 0.0403 0.0393
Toxoplasma gondii NADPH-glutathione reductase 0.0017 0.0025 0.0015
Trypanosoma cruzi hexokinase, putative 0.0123 0.0624 0.0615
Entamoeba histolytica hexokinase 2 0.0123 0.0624 0.0811
Treponema pallidum octaprenyl-diphosphate synthase 0.176 0.9932 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0198 0.0198
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0089 0.0079
Loa Loa (eye worm) hexokinase 0.0038 0.0143 0.0134
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0125 0.0637 0.0992
Chlamydia trachomatis geranylgeranyl pyrophosphate synthase 0.0704 0.3928 0.6224
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.0025 0.0015
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.0198 0.0189
Trichomonas vaginalis prokaryotic DNA topoisomerase, putative 0.0367 0.2016 0.1996
Mycobacterium tuberculosis Probable DNA polymerase III (alpha chain) DnaE1 (DNA nucleotidyltransferase) 0.1126 0.6329 0.6325
Wolbachia endosymbiont of Brugia malayi uracil-DNA glycosylase 0.0032 0.0108 0.0133
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0198 0.0198
Echinococcus multilocularis tumor protein p63 0.038 0.2087 0.2087
Brugia malayi hypothetical protein 0.0037 0.0141 0.0131
Toxoplasma gondii ABC1 family protein 0.004 0.0158 0.0148
Trypanosoma brucei DNA topoisomerase III, putative 0.1151 0.6468 0.6465
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0283 0.1538 0.2247
Echinococcus granulosus decaprenyl diphosphate synthase subunit 1 0.0704 0.3928 0.3928
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0068 0.0313 0.0313
Trypanosoma brucei hypothetical protein, conserved 0.004 0.0158 0.0148
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0283 0.1538 0.153
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0025 0.0015
Schistosoma mansoni hypothetical protein 0.0014 0.001 0.001
Schistosoma mansoni hypothetical protein 0.0555 0.3081 0.3081
Trichomonas vaginalis geranylgeranyl pyrophosphate synthase, putative 0.1772 1 1
Plasmodium falciparum DNA topoisomerase 3, putative 0.0651 0.3626 0.361
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0017 0.0025 0.0015
Echinococcus granulosus geminin 0.0555 0.3081 0.3081
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0017 0.0025 0.0015
Mycobacterium tuberculosis Conserved hypothetical protein 0.0212 0.1132 0.1124
Leishmania major mitochondrial DNA topoisomerase II 0.0283 0.1538 0.153
Brugia malayi Hexokinase family protein 0.0123 0.0624 0.0615
Mycobacterium leprae conserved hypothetical protein 0.0032 0.0108 0.0156
Schistosoma mansoni glutathione synthetase 0.0704 0.3928 0.3928
Schistosoma mansoni hypothetical protein 0.0455 0.2512 0.2512
Leishmania major DNA topoisomerase III, putative 0.1151 0.6468 0.6465
Onchocerca volvulus 0.004 0.0158 0.0076
Onchocerca volvulus 0.0054 0.0232 0.0194
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0158 0.0148
Plasmodium falciparum DNA topoisomerase 2 0.0283 0.1538 0.1517
Brugia malayi GRF zinc finger family protein 0.0283 0.1538 0.153
Mycobacterium tuberculosis Probable conserved lipoprotein 0.004 0.0158 0.0148
Echinococcus granulosus DNA topoisomerase 3 beta 1 0.1151 0.6468 0.6468
Mycobacterium tuberculosis Probable lipase LipE 0.004 0.0158 0.0148
Mycobacterium tuberculosis Probable reductase 0.0112 0.0566 0.0556
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0283 0.1538 0.2247
Toxoplasma gondii uracil-DNA glycosylase 0.0074 0.035 0.0341
Brugia malayi Uracil-DNA glycosylase 0.0074 0.035 0.0341
Echinococcus multilocularis farnesyl pyrophosphate synthase 0.1772 1 1
Trichomonas vaginalis esterase, putative 0.004 0.0158 0.0133
Echinococcus granulosus uracil DNA glycosylase 0.0074 0.035 0.035
Entamoeba histolytica DNA topoisomerase III, putative 0.1151 0.6468 1
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.0089 0.0079
Entamoeba histolytica geranylgeranyl pyrophosphate synthetase, putative 0.0704 0.3928 0.6006
Trypanosoma brucei trypanothione reductase 0.0049 0.0207 0.0198
Echinococcus granulosus DNA topoisomerase 3 alpha 0.0651 0.3626 0.3626
Trypanosoma cruzi DNA topoisomerase IA, putative 0.0651 0.3626 0.362
Onchocerca volvulus Hexokinase homolog 0.0077 0.0365 0.0402
Onchocerca volvulus 0.0123 0.0624 0.081
Echinococcus granulosus cpg binding protein 0.0034 0.012 0.012
Wolbachia endosymbiont of Brugia malayi geranylgeranyl pyrophosphate synthase 0.0704 0.3928 0.6224
Mycobacterium leprae conserved hypothetical protein 0.004 0.0158 0.0234
Plasmodium vivax thioredoxin reductase, putative 0.0049 0.0207 0.0183
Wolbachia endosymbiont of Brugia malayi topoisomerase IA, TopA 0.0651 0.3626 0.5743
Onchocerca volvulus Putative DNA topoisomerase 2, mitochondrial 0.0283 0.1538 0.2247
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0017 0.0025 0.0015
Loa Loa (eye worm) thioredoxin reductase 0.0049 0.0207 0.0198
Mycobacterium tuberculosis Conserved protein 0.004 0.0158 0.0148
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0017 0.0025 0.0015
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.004 0.0158 0.0148
Trypanosoma cruzi farnesyl pyrophosphate synthase, putative 0.1772 1 1
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0017 0.0025 0.0015
Onchocerca volvulus 0.1151 0.6468 1
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0158 0.0148
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0054 0.0232 0.0223
Chlamydia trachomatis DNA polymerase III subunit alpha 0.1121 0.6296 1
Loa Loa (eye worm) DNA topoisomerase III beta-1 0.1151 0.6468 0.6465
Trypanosoma cruzi trypanothione reductase, putative 0.0049 0.0207 0.0198
Leishmania major uracil-DNA-glycosylase, putative 0.0074 0.035 0.0341
Plasmodium vivax DNA gyrase subunit B, putative 0.0283 0.1538 0.1517
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.004 0.0158 0.0148
Trypanosoma brucei hexokinase, putative 0.0123 0.0624 0.0615
Loa Loa (eye worm) hypothetical protein 0.0039 0.0149 0.014
Brugia malayi Polyprenyl synthetase family protein 0.0704 0.3928 0.3922
Toxoplasma gondii polyprenyl synthetase superfamily protein 0.1772 1 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.004 0.0158 0.0148
Loa Loa (eye worm) polyprenyl synthetase 0.0704 0.3928 0.3922
Trypanosoma brucei solanesyl-diphosphate synthase, putative 0.0704 0.3928 0.3922
Trichomonas vaginalis DNA topoisomerase II, putative 0.0283 0.1538 0.1517
Leishmania major DNA topoisomerase 1A 0.0651 0.3626 0.362
Trypanosoma cruzi hexokinase, putative 0.0123 0.0624 0.0615
Loa Loa (eye worm) hypothetical protein 0.004 0.0158 0.0148
Loa Loa (eye worm) hypothetical protein 0.004 0.0158 0.0148
Plasmodium falciparum octaprenyl pyrophosphate synthase 0.0704 0.3928 0.3913
Leishmania major solanesyl-diphosphate synthase, putative 0.0704 0.3928 0.3922
Onchocerca volvulus 0.0077 0.0365 0.0402
Chlamydia trachomatis DNA gyrase subunit B 0.0283 0.1538 0.2413
Loa Loa (eye worm) beta-lactamase 0.004 0.0158 0.0148
Brugia malayi hypothetical protein 0.0028 0.0089 0.0079
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0049 0.0207 0.0198
Onchocerca volvulus 0.004 0.0158 0.0076
Chlamydia trachomatis DNA gyrase subunit B 0.0283 0.1538 0.2413
Trypanosoma brucei DNA topoisomerase IA, putative 0.0651 0.3626 0.362
Mycobacterium ulcerans glycosylase 0.0032 0.0108 0.0099
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0125 0.0637 0.0628
Brugia malayi geranylgeranyl pyrophosphate synthetase 0.176 0.9932 0.9932
Loa Loa (eye worm) polyprenyl synthetase 0.1772 1 1
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0158 0.0133
Mycobacterium leprae PROBABLE POLYPRENYL-DIPHOSPHATE SYNTHASE GRCC1 (POLYPRENYL PYROPHOSPHATE SYNTHETASE) 0.0704 0.3928 0.6201
Echinococcus multilocularis hexokinase 0.0123 0.0624 0.0624
Schistosoma mansoni cpg binding protein 0.0034 0.012 0.012
Entamoeba histolytica uracil-DNA glycosylase, putative 0.0074 0.035 0.0381
Trypanosoma brucei farnesyl pyrophosphate synthase 0.1772 1 1
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0017 0.0025 0.0015
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0017 0.0025 0.0015
Mycobacterium ulcerans DNA topoisomerase I 0.0651 0.3626 0.362
Mycobacterium tuberculosis Conserved protein 0.004 0.0158 0.0148
Brugia malayi Hexokinase family protein 0.0038 0.0143 0.0134
Mycobacterium ulcerans polyprenyl synthetase IdsB 0.0704 0.3928 0.3922
Loa Loa (eye worm) hypothetical protein 0.004 0.0158 0.0148
Mycobacterium tuberculosis Probable DNA polymerase III (alpha chain) DnaE2 (DNA nucleotidyltransferase) 0.1126 0.6329 0.6325
Echinococcus granulosus thioredoxin glutathione reductase 0.0049 0.0207 0.0207
Plasmodium vivax glutathione reductase, putative 0.0049 0.0207 0.0183
Schistosoma mansoni trans-prenyltransferase 0.0704 0.3928 0.3928
Trypanosoma brucei DNA topoisomerase III, putative 0.0651 0.3626 0.362
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0089 0.0064
Treponema pallidum DNA polymerase III subunit alpha 0.1121 0.6296 0.633
Loa Loa (eye worm) uracil-DNA glycosylase 0.0074 0.035 0.0341
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0198 0.0198
Loa Loa (eye worm) hypothetical protein 0.004 0.0158 0.0148
Echinococcus granulosus hexokinase 0.0123 0.0624 0.0624
Plasmodium vivax DNA topoisomerase 3, putative 0.0651 0.3626 0.361
Toxoplasma gondii polyprenyl synthetase superfamily protein 0.0704 0.3928 0.3922
Echinococcus multilocularis rho GTPase activating protein 20 0.0651 0.3626 0.3626
Entamoeba histolytica hypothetical protein 0.0037 0.0141 0.0051
Plasmodium vivax DNA topoisomerase II, putative 0.0283 0.1538 0.1517
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0283 0.1538 0.153
Plasmodium falciparum hexokinase 0.0123 0.0624 0.0601
Entamoeba histolytica geranylgeranyl pyrophosphate synthase, putative 0.0704 0.3928 0.6006
Trypanosoma brucei uracil-DNA glycosylase, putative 0.0074 0.035 0.0341
Trypanosoma cruzi farnesyl pyrophosphate synthase 0.1772 1 1
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0158 0.0133
Loa Loa (eye worm) hexokinase 0.0077 0.0365 0.0355
Mycobacterium ulcerans hypothetical protein 0.0212 0.1132 0.1124
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0198 0.0198
Mycobacterium tuberculosis Probable esterase LipL 0.004 0.0158 0.0148
Echinococcus granulosus DNA topoisomerase 2 alpha 0.0283 0.1538 0.1538
Mycobacterium ulcerans hypothetical protein 0.004 0.0158 0.0148
Mycobacterium ulcerans geranylgeranyl pyrophosphate synthase 0.1772 1 1
Mycobacterium ulcerans DNA polymerase III subunit alpha 0.1121 0.6296 0.6293
Mycobacterium tuberculosis Probable hydrolase 0.004 0.0158 0.0148
Leishmania major hexokinase, putative 0.0123 0.0624 0.0615
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0112 0.0566 0.0556
Trichomonas vaginalis geranylgeranyl pyrophosphate synthase, putative 0.1772 1 1
Mycobacterium tuberculosis Probable geranylgeranyl pyrophosphate synthetase IdsA2 (ggppsase) (GGPP synthetase) (geranylgeranyl diphosphate synthase) 0.1772 1 1
Treponema pallidum DNA topoisomerase I (topA) 0.0651 0.3626 0.3635
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0017 0.0025 0.0015
Echinococcus granulosus cytochrome P450 2K1 0.0014 0.001 0.001
Echinococcus multilocularis hexokinase 0.0123 0.0624 0.0624
Loa Loa (eye worm) hypothetical protein 0.004 0.0158 0.0148
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0017 0.0025 0.0025
Loa Loa (eye worm) hexokinase type II 0.0123 0.0624 0.0615
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0017 0.0025 0.0025
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0017 0.0025 0.0025
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0141 0.0141
Schistosoma mansoni cellular tumor antigen P53 0.0056 0.0244 0.0244
Echinococcus multilocularis geminin 0.0555 0.3081 0.3081
Loa Loa (eye worm) hypothetical protein 0.004 0.0158 0.0148
Treponema pallidum hexokinase (hxk) 0.0123 0.0624 0.0605
Giardia lamblia DNA topoisomerase III 0.0651 0.3626 0.361
Mycobacterium tuberculosis Conserved protein 0.004 0.0158 0.0148
Schistosoma mansoni geranylgeranyl pyrophosphate synthase 0.176 0.9932 0.9932
Trypanosoma cruzi DNA topoisomerase III, putative 0.0651 0.3626 0.362
Leishmania major hypothetical protein, conserved 0.004 0.0158 0.0148
Schistosoma mansoni hypothetical protein 0.0037 0.0141 0.0141
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0259 0.1398 0.1389
Trichomonas vaginalis prokaryotic DNA topoisomerase, putative 0.0651 0.3626 0.361
Plasmodium vivax octaprenyl pyrophosphate synthase, putative 0.0704 0.3928 0.3913
Loa Loa (eye worm) geranylgeranyl pyrophosphate synthetase 0.176 0.9932 0.9932
Mycobacterium leprae PROBABLE URACIL-DNA GLYCOSYLASE UNG (UDG) 0.0074 0.035 0.0539
Trypanosoma cruzi uracil-DNA glycosylase 0.0074 0.035 0.0341
Toxoplasma gondii DNA topoisomerase 2, putative 0.0283 0.1538 0.153
Brugia malayi Probable DNA topoisomerase II 0.0283 0.1538 0.153
Mycobacterium tuberculosis Probable dehydrogenase 0.0112 0.0566 0.0556
Trypanosoma cruzi DNA topoisomerase IA, putative 0.0651 0.3626 0.362
Mycobacterium tuberculosis Probable polyprenyl-diphosphate synthase GrcC2 (polyprenyl pyrophosphate synthetase) 0.0704 0.3928 0.3922
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0025 0.0015
Loa Loa (eye worm) DNA topoisomerase III 0.0651 0.3626 0.362
Schistosoma mansoni hypothetical protein 0.0054 0.0232 0.0232
Toxoplasma gondii thioredoxin reductase 0.0049 0.0207 0.0198
Schistosoma mansoni hypothetical protein 0.0555 0.3081 0.3081
Echinococcus multilocularis decaprenyl diphosphate synthase subunit 1 0.0704 0.3928 0.3928
Schistosoma mansoni cpg binding protein 0.0032 0.0109 0.0109
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.0089 0.0079
Mycobacterium ulcerans polyprenyl diphosphate synthetase, GrcC1 0.0704 0.3928 0.3922
Trypanosoma brucei hexokinase 0.0123 0.0624 0.0615
Trypanosoma cruzi solanesyl-diphosphate synthase, putative 0.0704 0.3928 0.3922
Onchocerca volvulus 0.0056 0.0244 0.0212
Mycobacterium ulcerans uracil-DNA glycosylase 0.0074 0.035 0.0341
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0025 0.0015
Echinococcus granulosus dnaJ subfamily B 0.0455 0.2512 0.2512
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0158 0.0158
Echinococcus multilocularis cpg binding protein 0.0034 0.012 0.012
Schistosoma mansoni prokaryotic DNA topoisomerase 0.1151 0.6468 0.6468
Brugia malayi hexokinase type II 0.0039 0.0149 0.014
Trypanosoma cruzi DNA topoisomerase III, putative 0.0651 0.3626 0.362
Echinococcus granulosus hexokinase 0.0123 0.0624 0.0624
Entamoeba histolytica hypothetical protein 0.0037 0.0141 0.0051
Plasmodium vivax uracil-DNA glycosylase, putative 0.0074 0.035 0.0326
Schistosoma mansoni G/t mismatch-specific thymine DNA glycosylase 0.0032 0.0108 0.0108
Mycobacterium tuberculosis DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.0283 0.1538 0.153
Mycobacterium tuberculosis Possible polyprenyl synthetase IdsB (polyprenyl transferase) (polyprenyl diphosphate synthase) 0.0704 0.3928 0.3922
Mycobacterium tuberculosis Probable multifunctional geranylgeranyl pyrophosphate synthetase IdsA1 (GGPP synthetase) (ggppsase) (geranylgeranyl diphosphate 0.0704 0.3928 0.3922
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0158 0.0133
Brugia malayi hypothetical protein 0.0263 0.1422 0.1413
Brugia malayi DNA topoisomerase III beta-1 0.1151 0.6468 0.6465
Plasmodium falciparum geranylgeranyl pyrophosphate synthase, putative 0.1772 1 1
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0017 0.0025 0.0015
Giardia lamblia DNA topoisomerase II 0.0283 0.1538 0.1517
Loa Loa (eye worm) hypothetical protein 0.0028 0.0089 0.0079
Echinococcus granulosus hexokinase 0.0123 0.0624 0.0624
Echinococcus multilocularis DNA topoisomerase 2 alpha 0.0283 0.1538 0.1538
Mycobacterium ulcerans hypothetical protein 0.0032 0.0108 0.0099
Wolbachia endosymbiont of Brugia malayi geranylgeranyl pyrophosphate synthase 0.0704 0.3928 0.6224
Mycobacterium ulcerans beta-lactamase 0.004 0.0158 0.0148
Plasmodium falciparum uracil-DNA glycosylase 0.0074 0.035 0.0326
Echinococcus multilocularis survival motor neuron protein 1 0.0263 0.1422 0.1422
Plasmodium vivax hypothetical protein, conserved 0.004 0.0158 0.0133
Brugia malayi Thioredoxin reductase 0.0049 0.0207 0.0198
Giardia lamblia DNA topoisomerase III 0.1151 0.6468 0.6459
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0025 0.0015
Echinococcus granulosus survival motor neuron protein 1 0.0263 0.1422 0.1422
Toxoplasma gondii histone lysine methyltransferase SET1 0.006 0.0271 0.0262
Mycobacterium tuberculosis Probable lipase LipD 0.004 0.0158 0.0148
Schistosoma mansoni survival motor neuron protein 0.0054 0.0232 0.0232
Mycobacterium tuberculosis Probable uracil DNA glycosylase, UdgB 0.0032 0.0108 0.0099
Toxoplasma gondii DNA topoisomerase domain-containing protein 0.0651 0.3626 0.362
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0017 0.0025 0.0015
Entamoeba histolytica DNA topoisomerase II, putative 0.0283 0.1538 0.2248
Echinococcus multilocularis prenyl (decaprenyl) diphosphate synthase 0.0704 0.3928 0.3928
Toxoplasma gondii hexokinase 0.0123 0.0624 0.0615
Echinococcus multilocularis dnaJ subfamily B 0.0455 0.2512 0.2512
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0283 0.1538 0.153
Echinococcus multilocularis 0.0014 0.001 0.001
Schistosoma mansoni hexokinase 0.0123 0.0624 0.0624
Mycobacterium leprae Probable DNA topoisomerase I TopA (omega-protein) (relaxing enzyme) (untwisting enzyme) (swivelase) (type I DNA topoisomerase) ( 0.0651 0.3626 0.5723
Schistosoma mansoni DNA topoisomerase II 0.0283 0.1538 0.1538
Loa Loa (eye worm) hexokinase 0.0123 0.0624 0.0615
Trypanosoma cruzi solanesyl-diphosphate synthase, putative 0.0704 0.3928 0.3922
Brugia malayi CXXC zinc finger family protein 0.0032 0.0109 0.01
Leishmania major DNA topoisomerase III, putative 0.0651 0.3626 0.362
Mycobacterium ulcerans lipase LipD 0.004 0.0158 0.0148
Leishmania major hypothetical protein, conserved 0.0028 0.0089 0.0079
Brugia malayi DNA topoisomerase III 0.0651 0.3626 0.362
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.004 0.0158 0.0148
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0198 0.0198
Loa Loa (eye worm) hexokinase 0.0123 0.0624 0.0615
Plasmodium falciparum thioredoxin reductase 0.0049 0.0207 0.0183
Brugia malayi hexokinase 0.0123 0.0624 0.0615
Schistosoma mansoni prokaryotic DNA topoisomerase 0.0651 0.3626 0.3626
Echinococcus granulosus geranylgeranyl pyrophosphate synthase 0.176 0.9932 0.9932
Trichomonas vaginalis geranylgeranyl diphosphate synthase, putative 0.1772 1 1
Leishmania major farnesyl pyrophosphate synthase 0.1772 1 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0025 0.0015
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0025 0.0015
Mycobacterium tuberculosis Probable oxidoreductase 0.0125 0.0637 0.0628
Trypanosoma cruzi polyprenyl synthase, putative 0.176 0.9932 0.9932
Loa Loa (eye worm) hypothetical protein 0.0039 0.0149 0.014
Wolbachia endosymbiont of Brugia malayi DNA gyrase, topoisomerase II, B subunit, GyrB 0.0283 0.1538 0.2413
Echinococcus multilocularis thioredoxin glutathione reductase 0.0049 0.0207 0.0207
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0089 0.0079
Plasmodium falciparum DNA gyrase subunit B 0.0283 0.1538 0.1517
Schistosoma mansoni uracil-DNA glycosylase 0.0074 0.035 0.035
Brugia malayi hypothetical protein 0.0018 0.0032 0.0022
Brugia malayi beta-lactamase family protein 0.004 0.0158 0.0148
Echinococcus granulosus prenyl decaprenyl diphosphate synthase 0.0704 0.3928 0.3928
Echinococcus multilocularis hexokinase 0.0123 0.0624 0.0624
Brugia malayi beta-lactamase family protein 0.004 0.0158 0.0148
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.0089 0.0064
Entamoeba histolytica hypothetical protein 0.0037 0.0141 0.0051
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0158 0.0133
Chlamydia trachomatis DNA topoisomerase I 0.0651 0.3626 0.5743
Trypanosoma cruzi solanesyl-diphosphate synthase 0.0704 0.3928 0.3922
Echinococcus granulosus farnesyl pyrophosphate synthase 0.1772 1 1

Activities

Activity type Activity value Assay description Source Reference
Inhibition (binding) No inhibition 0 mM Inhibition constant for human placental alkaline phosphatase at pH 9; No reduction in rate ChEMBL. 15501071
Inhibition (binding) = 0.13 mM Inhibition constant protein phosphatase 2C in presence of [Mn2+] at 5 mM pH 7.5 ChEMBL. 15501071
Inhibition (binding) = 0.19 mM Inhibition constant for lambda protein phosphatase in presence of [Mn2+] at 5 mM pH 7.3 ChEMBL. 15501071
Inhibition (binding) = 0.19 mM Inhibition constant for lambda protein phosphatase in presence of [Mn2+] at 5 mM pH 7.3 ChEMBL. 15501071
Inhibition (binding) = 5.1 mM Inhibition constant for Escherichia coli alkaline phosphatase at pH 9 ChEMBL. 15501071
Inhibition (binding) = 5.1 mM Inhibition constant for Escherichia coli alkaline phosphatase at pH 9 ChEMBL. 15501071
Inhibition (binding) = 12 mM Inhibition constant for YOP protein tyrosine phosphatase at pH 6.6 ChEMBL. 15501071
Inhibition (binding) = 12 mM Inhibition constant for YOP protein tyrosine phosphatase at pH 6.6 ChEMBL. 15501071
Ki (binding) = 1.1 mM Compound was evaluated for the inhibition constant against Protein-tyrosine phosphatase (PTP1B ) ChEMBL. 10743947
Ki (binding) = 2.6 mM Compound was evaluated for the inhibition constant against dual specificity phosphatase VHR ChEMBL. 10743947

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

2 literature references were collected for this gene.

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