Detailed information for compound 59496

Basic information

Technical information
  • TDR Targets ID: 59496
  • Name: dimethyl 2-[(6-oxo-3-phenyl-1H-pyridazin-4-yl )methylidene]propanedioate
  • MW: 314.293 | Formula: C16H14N2O5
  • H donors: 1 H acceptors: 3 LogP: 1.61 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)C(=Cc1cc(=O)[nH]nc1c1ccccc1)C(=O)OC
  • InChi: 1S/C16H14N2O5/c1-22-15(20)12(16(21)23-2)8-11-9-13(19)17-18-14(11)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,17,19)
  • InChiKey: DNBWXZNCAQQMOU-UHFFFAOYSA-N  

Network

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Synonyms

  • dimethyl 2-[(6-oxo-3-phenyl-1H-pyridazin-4-yl)methylene]propanedioate
  • 2-[(6-oxo-3-phenyl-1H-pyridazin-4-yl)methylene]propanedioic acid dimethyl ester
  • 2-[(6-keto-3-phenyl-1H-pyridazin-4-yl)methylene]malonic acid dimethyl ester

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 ulcerans flavoprotein disulfide reductase 0.0032 0.0119 0.0113
Giardia lamblia Plasma membrane calcium-transporting ATPase 2 0.0016 0.0034 0.1723
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0213 0.1076 0.1495
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.0016 0.0307
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0213 0.1076 0.1495
Echinococcus multilocularis Ca2+ transporting ATPase plasma membrane 0.0013 0.0016 0.0062
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0008 0.0185
Schistosoma mansoni Na+/K+ transporting ATPase subunit alpha 0.0016 0.0034 0.0128
Brugia malayi Smad1 0.0016 0.0032 0.0269
Toxoplasma gondii NADPH-glutathione reductase 0.0032 0.0119 0.0426
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Trypanosoma brucei DNA damage repair protein, putative 0.0012 0.001 0.0169
Brugia malayi MH2 domain containing protein 0.0016 0.0032 0.0269
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0012 0.001 0.0034
Trichomonas vaginalis chromobox protein, putative 0.0042 0.0172 0.5342
Entamoeba histolytica calcium-transporting P-type ATPase, putative 0.0016 0.0034 0.08
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0156 0.4843
Brugia malayi MH2 domain containing protein 0.0236 0.1197 1
Trichomonas vaginalis pc-MYB2, putative 0.0047 0.0194 0.6038
Trichomonas vaginalis DNA helicase recq1, putative 0.0024 0.0075 0.2308
Giardia lamblia NADH oxidase lateral transfer candidate 0.0032 0.0119 0.608
Echinococcus multilocularis geminin 0.0506 0.2627 1
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0038 0.0148 0.124
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0032 0.0119 0.2647
Loa Loa (eye worm) hypothetical protein 0.0017 0.0035 0.0295
Echinococcus granulosus Chromobox protein 3 0.0012 0.0008 0.003
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0016 0.0034 0.0992
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.0016 0.0307
Brugia malayi M-phase phosphoprotein, mpp8 0.0012 0.0008 0.0067
Mycobacterium tuberculosis Conserved hypothetical protein 0.0038 0.0148 0.0199
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0008 0.0185
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0012 0.0008 0.0181
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0008 0.0185
Trichomonas vaginalis cation-transporting ATPase, putative 0.0016 0.0034 0.0992
Plasmodium falciparum glutathione reductase 0.0093 0.0442 1
Brugia malayi CHD4 protein 0.0012 0.0008 0.0067
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0032 0.0119 0.0113
Schistosoma mansoni hypothetical protein 0.0016 0.003 0.0113
Toxoplasma gondii calcium-translocating P-type ATPase, PMCA-type protein 0.0016 0.0034 0.0121
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0279 0.1064
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Trypanosoma cruzi calcium motive p-type ATPase, putative 0.0013 0.0016 0.0323
Brugia malayi Bloom's syndrome protein homolog 0.0024 0.0075 0.063
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0013 0.0016 0.0447
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0279 0.1064
Entamoeba histolytica hypothetical protein 0.0072 0.0328 1
Leishmania major calcium-translocating P-type ATPase 0.0028 0.0094 0.2091
Trypanosoma brucei vacuolar-type Ca2+-ATPase, putative 0.0016 0.0034 0.0716
Plasmodium falciparum DNA repair protein REV1, putative 0.0012 0.001 0.0215
Mycobacterium tuberculosis Probable dehydrogenase 0.0213 0.1076 0.1495
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0209 0.1744
Giardia lamblia Myb 1-like protein 0.0047 0.0195 1
Schistosoma mansoni chromobox protein 0.0012 0.0008 0.003
Schistosoma mansoni hypothetical protein 0.0011 0.0007 0.0028
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0016 0.0033 0.0118
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0032 0.0119 0.2682
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0072 0.0328 0.125
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0016 0.0032 0.0122
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.003 0.0113
Loa Loa (eye worm) hypothetical protein 0.0012 0.0008 0.0067
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0063 0.0279 0.2336
Brugia malayi polk-prov protein 0.0012 0.001 0.008
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.003 0.0113
Brugia malayi hypothetical protein 0.0025 0.0082 0.0684
Echinococcus granulosus Smad4 0.0016 0.0032 0.0122
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0038 0.0148 0.0565
Trypanosoma cruzi hypothetical protein, conserved 0.0012 0.001 0.0169
Loa Loa (eye worm) hypothetical protein 0.0012 0.0008 0.0067
Trypanosoma brucei unspecified product 0.0026 0.0086 0.1905
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0008 0.0185
Echinococcus multilocularis Tetracycline resistance leader peptide, TetL 0.0016 0.0034 0.0128
Trypanosoma brucei hypothetical protein, conserved 0.0012 0.001 0.0169
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.003 0.0113
Leishmania major DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Trypanosoma cruzi trypanothione reductase, putative 0.0093 0.0442 1
Brugia malayi hypothetical protein 0.0016 0.0034 0.0284
Entamoeba histolytica recQ family helicase, putative 0.0013 0.0016 0.0237
Echinococcus multilocularis smad 0.0016 0.0032 0.0122
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0008 0.0185
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0032 0.0119 0.0451
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0082 0.1701
Trypanosoma cruzi Calcium ATPase SERCA-like 0.0028 0.0094 0.2091
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0032 0.0119 0.0451
Trypanosoma brucei DNA polymerase kappa, putative 0.0012 0.001 0.0169
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0012 0.0008 0.003
Trypanosoma cruzi calcium motive p-type ATPase, putative 0.0013 0.0016 0.0323
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.0012 0.0008 0.003
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0037 0.0142 0.0512
Loa Loa (eye worm) hypothetical protein 0.0012 0.001 0.008
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0032 0.0119 0.2647
Plasmodium vivax calcium-transporting ATPase, putative 0.0028 0.0094 0.1984
Entamoeba histolytica hypothetical protein 0.0072 0.0328 1
Schistosoma mansoni smad1 5 8 and 0.0016 0.0032 0.0122
Giardia lamblia Potassium-transporting ATPase alpha chain 1 0.0013 0.0016 0.0836
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0032 0.0119 0.2647
Echinococcus granulosus chromodomain helicase DNA binding protein 1 0.0012 0.0008 0.003
Trichomonas vaginalis C-MYB, putative 0.0047 0.0194 0.6038
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0082 0.1812
Plasmodium falciparum thioredoxin reductase 0.0093 0.0442 1
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0038 0.0148 0.0565
Echinococcus multilocularis calcium transporting ATPase type 2C member 0.0028 0.0094 0.0358
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0032 0.0119 0.2647
Schistosoma mansoni chromobox protein 0.007 0.032 0.1217
Trichomonas vaginalis chromobox protein, putative 0.007 0.032 1
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0047 0.0194 0.6038
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.0016 0.0034 0.08
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0047 0.0195 0.6075
Trichomonas vaginalis DNA helicase recq, putative 0.0013 0.0016 0.0425
Entamoeba histolytica hypothetical protein 0.0012 0.0008 0.00000000068232
Loa Loa (eye worm) thioredoxin reductase 0.0093 0.0442 0.3693
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0008 0.0185
Trichomonas vaginalis C-MYB, putative 0.0047 0.0194 0.6038
Brugia malayi E1-E2 ATPase family protein 0.001 0.0002 0.0018
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0032 0.0119 0.2647
Trichomonas vaginalis chromobox protein, putative 0.0012 0.0008 0.0185
Trichomonas vaginalis pc-MYB2, putative 0.0047 0.0194 0.6038
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0016 0.0034 0.0595
Giardia lamblia DINP protein human, muc B family 0.0038 0.0148 0.7614
Trypanosoma cruzi DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0012 0.0008 0.003
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0016 0.0032 0.0122
Loa Loa (eye worm) helicase 0.0012 0.0008 0.0067
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0008 0.00000000068232
Echinococcus multilocularis Chromo domain 0.0012 0.0008 0.003
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0038 0.0148 0.0199
Entamoeba histolytica hypothetical protein 0.0072 0.0328 1
Echinococcus granulosus dna polymerase eta 0.0063 0.0281 0.1071
Echinococcus multilocularis chromobox protein 1 0.007 0.032 0.1217
Trypanosoma brucei DNA polymerase eta, putative 0.0063 0.0281 0.6349
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0008 0.0185
Wolbachia endosymbiont of Brugia malayi UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1899 1 1
Echinococcus multilocularis mothers against decapentaplegic 5 0.0016 0.0032 0.0122
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0012 0.0008 0.003
Schistosoma mansoni plasma membrane calcium-transporting atpase 0.0013 0.0016 0.0062
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0008 0.0185
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0008 0.0185
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0032 0.0119 0.0426
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0156 0.4843
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0237 0.1202 0.1671
Trypanosoma cruzi calcium-translocating P-type ATPase, putative 0.0017 0.0039 0.0838
Plasmodium vivax glutathione reductase, putative 0.0093 0.0442 1
Toxoplasma gondii sarco/endoplasmic reticulum Ca2+-ATPase 0.0028 0.0094 0.0338
Toxoplasma gondii P-type ATPase PMA1 0.001 0.0002 0.0008
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.0016 0.0034 0.08
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0008 0.0185
Loa Loa (eye worm) hypothetical protein 0.0016 0.0034 0.0281
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0082 0.1851
Mycobacterium ulcerans UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1899 1 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0008 0.0185
Schistosoma mansoni hypothetical protein 0.0012 0.0008 0.003
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0012 0.0008 0.003
Trypanosoma brucei trypanothione reductase 0.0093 0.0442 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0008 0.0067
Schistosoma mansoni smad1 5 8 and 0.0016 0.0032 0.0122
Brugia malayi Latrophilin receptor protein 2 0.0016 0.003 0.0249
Echinococcus granulosus mothers against decapentaplegic 5 0.0016 0.0032 0.0122
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0008 0.0185
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0047 0.0194 0.5802
Schistosoma mansoni hypothetical protein 0.0016 0.003 0.0113
Schistosoma mansoni blooms syndrome DNA helicase 0.0019 0.0048 0.0184
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0072 0.0328 0.125
Trypanosoma brucei DNA polymerase kappa, putative 0.0026 0.0086 0.1905
Trypanosoma brucei DNA polymerase kappa, putative 0.0026 0.0086 0.1905
Loa Loa (eye worm) hypothetical protein 0.0028 0.0094 0.0786
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0024 0.0073 0.061
Mycobacterium tuberculosis Probable metal cation transporter P-type ATPase A CtpF 0.0011 0.0007 0.0002
Loa Loa (eye worm) hypothetical protein 0.0039 0.0156 0.1302
Loa Loa (eye worm) Smad1 0.0016 0.0032 0.0269
Brugia malayi Heterochromatin protein 1 0.007 0.032 0.2671
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Trichomonas vaginalis DNA polymerase eta, putative 0.0038 0.0148 0.4609
Schistosoma mansoni DNA polymerase IV / kappa 0.0012 0.001 0.0036
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0032 0.0119 0.2647
Trichomonas vaginalis cation-transporting ATPase, putative 0.0028 0.0094 0.2896
Echinococcus granulosus chromobox protein 1 0.007 0.032 0.1217
Trypanosoma cruzi DNA polymerase eta, putative 0.0037 0.0142 0.3191
Trypanosoma brucei vacuolar-type Ca2+-ATPase 1 0.0016 0.0034 0.0716
Toxoplasma gondii 'chromo' (CHRromatin Organization MOdifier) domain-containing protein 0.0012 0.0008 0.0029
Trypanosoma cruzi plasma membrane Ca2+ ATPase 0.0016 0.0034 0.0716
Loa Loa (eye worm) hypothetical protein 0.0016 0.003 0.0249
Trichomonas vaginalis Heterochromatin protein, putative 0.0012 0.0008 0.0185
Loa Loa (eye worm) MH1 domain-containing protein 0.0016 0.0032 0.0269
Leishmania major vacuolar-type Ca2 -ATPase, putative 0.0016 0.0034 0.0716
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0047 0.0194 0.5802
Schistosoma mansoni calcium-transporting atpase sarcoplasmic/endoplasmic reticulum type (calcium pump) 0.0025 0.0077 0.0292
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0213 0.1076 0.1495
Loa Loa (eye worm) RNA binding protein 0.0063 0.0279 0.2336
Brugia malayi Protein cec-1. 0.0012 0.0008 0.0067
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0032 0.0119 0.2647
Schistosoma mansoni hypothetical protein 0.0016 0.003 0.0113
Toxoplasma gondii shikimate dehydrogenase substrate binding domain-containing protein 0.0535 0.2781 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0082 0.1812
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.0016 0.0307
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0038 0.0148 0.4609
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0032 0.0119 0.2647
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0011 0.0007 0.0028
Plasmodium falciparum heterochromatin protein 1 0.0012 0.0008 0.0181
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0016 0.0034 0.0992
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0008 0.0185
Schistosoma mansoni plasma membrane calcium-transporting atpase 0.0013 0.0016 0.0062
Loa Loa (eye worm) MH2 domain-containing protein 0.0016 0.0032 0.0269
Trichomonas vaginalis chromobox protein, putative 0.0012 0.0008 0.0185
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0032 0.0119 0.2647
Mycobacterium tuberculosis Probable oxidoreductase 0.0237 0.1202 0.1671
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0209 0.1744
Brugia malayi TAR-binding protein 0.0063 0.0279 0.2336
Mycobacterium leprae PROBABLE UDP-N-ACETYLGLUCOSAMINE 1-CARBOXYVINYLTRANSFERASE MURA 0.1364 0.7166 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0213 0.1076 0.1495
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.0016 0.0034 0.08
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0032 0.0119 0.2682
Echinococcus multilocularis dna polymerase eta 0.0063 0.0281 0.1071
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0047 0.0194 0.6038
Toxoplasma gondii plasma membrane-type Ca(2+)-ATPase A1 PMCAA1 0.0013 0.0016 0.0059
Schistosoma mansoni smad1 5 8 and 0.0016 0.0032 0.0122
Loa Loa (eye worm) CHromoDomain protein family member 0.0012 0.0008 0.0067
Trypanosoma cruzi hypothetical protein, conserved 0.0012 0.001 0.0169
Loa Loa (eye worm) E1-E2 ATPase 0.001 0.0002 0.0018
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0008 0.0185
Echinococcus multilocularis tar DNA binding protein 0.0063 0.0279 0.1064
Trypanosoma brucei DNA polymerase IV, putative 0.0038 0.0148 0.3327
Mycobacterium ulcerans metal cation-transporting p-type ATPase F, CtpF 0.0028 0.0094 0.0088
Echinococcus granulosus thioredoxin glutathione reductase 0.0093 0.0442 0.1682
Echinococcus granulosus TGF beta signal transducer SmadC 0.0016 0.0032 0.0122
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0008 0.0185
Echinococcus granulosus sarco:endoplasmic reticulum calcium ATPase 0.0028 0.0094 0.0358
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.003 0.0249
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0008 0.0185
Brugia malayi Thioredoxin reductase 0.0093 0.0442 0.3693
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0279 0.1064
Brugia malayi hypothetical protein 0.0072 0.0328 0.2743
Leishmania major DNA polymerase eta, putative 0.0063 0.0281 0.6349
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0095 0.2922
Brugia malayi Membrane calcium atpase protein 3 0.0013 0.0016 0.0136
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0032 0.0119 0.0113
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0038 0.0148 0.0565
Brugia malayi glutathione reductase 0.0093 0.0442 0.3693
Echinococcus granulosus chromobox protein 2 0.0012 0.0008 0.003
Trypanosoma brucei DNA polymerase IV, putative 0.0038 0.0148 0.3327
Plasmodium vivax DNA repair protein REV1, putative 0.0012 0.001 0.0035
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0032 0.0119 0.099
Schistosoma mansoni hypothetical protein 0.0506 0.2627 1
Brugia malayi Na,K-ATPase alpha subunit 0.0016 0.0034 0.0281
Entamoeba histolytica deoxycytidyl transferase, putative 0.0038 0.0148 0.4385
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0047 0.0194 0.6038
Trypanosoma brucei unspecified product 0.0026 0.0086 0.1905
Loa Loa (eye worm) hypothetical protein 0.0012 0.0008 0.0067
Mycobacterium ulcerans metal cation transporter p-type ATPase a 0.0016 0.0034 0.0028
Loa Loa (eye worm) hypothetical protein 0.0012 0.0008 0.0067
Treponema pallidum UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1899 1 1
Schistosoma mansoni hypothetical protein 0.0072 0.0328 0.125
Brugia malayi Valyl-tRNA synthetase 0.0012 0.0008 0.0067
Echinococcus granulosus dna polymerase kappa 0.0038 0.0148 0.0565
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0213 0.1076 0.1495
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0032 0.0119 0.0157
Trypanosoma cruzi DNA damage repair protein, putative 0.0012 0.001 0.0169
Echinococcus multilocularis chromobox protein 2 0.0012 0.0008 0.003
Echinococcus granulosus bloom syndrome protein 0.0024 0.0075 0.0287
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0011 0.0007 0.0028
Loa Loa (eye worm) hypothetical protein 0.0025 0.0082 0.0684
Brugia malayi chromobox protein homolog 3 0.0039 0.0156 0.1302
Onchocerca volvulus 0.0016 0.0034 0.1564
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0008 0.0185
Chlamydia trachomatis phosphoshikimate 1-carboxyl vinyltransferase 0.0535 0.2781 0.2694
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0032 0.0119 0.2647
Loa Loa (eye worm) transcription factor SMAD2 0.0236 0.1197 1
Leishmania major hypothetical protein, conserved 0.0025 0.0082 0.1812
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0095 0.2922
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0032 0.0119 0.2647
Trichomonas vaginalis chromobox protein, putative 0.0042 0.0172 0.5342
Loa Loa (eye worm) hypothetical protein 0.0063 0.0281 0.2351
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0032 0.0119 0.2647
Trichomonas vaginalis glutathione reductase, putative 0.0032 0.0119 0.3667
Schistosoma mansoni na+/k+ atpase alpha subunit 0.0013 0.0016 0.0062
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0012 0.0008 0.003
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0008 0.0185
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0038 0.0148 0.3327
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0082 0.1812
Echinococcus multilocularis plasma membrane calcium transporting ATPase 0.0013 0.0016 0.0062
Trypanosoma cruzi DNA polymerase eta, putative 0.0063 0.0281 0.6349
Brugia malayi hypothetical protein 0.0012 0.0008 0.0067
Brugia malayi RNA recognition motif domain containing protein 0.0063 0.0279 0.2336
Schistosoma mansoni smad 0.0016 0.0032 0.0122
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0008 0.00000000068232
Trichomonas vaginalis MYB72, putative 0.0047 0.0194 0.6038
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0237 0.1202 0.1671
Loa Loa (eye worm) calcium-transporting ATPase sarcoplasmic/endoplasmic reticulum type 0.0019 0.0049 0.041
Echinococcus multilocularis Smad4 0.0016 0.0032 0.0122
Loa Loa (eye worm) heterochromatin protein 1 0.007 0.032 0.2671
Loa Loa (eye worm) hypothetical protein 0.0049 0.0209 0.1744
Trypanosoma brucei vacuolar-type Ca2+-ATPase 2 0.0016 0.0034 0.0716
Schistosoma mansoni hypothetical protein 0.0034 0.0126 0.0479
Trypanosoma brucei unspecified product 0.0038 0.0148 0.3327
Loa Loa (eye worm) hypothetical protein 0.0012 0.0008 0.0067
Plasmodium falciparum glutathione reductase 0.0032 0.0119 0.2682
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.003 0.0249
Loa Loa (eye worm) RecQ helicase 0.0024 0.0075 0.063
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.003 0.0113
Trichomonas vaginalis cation-transporting ATPase, putative 0.0028 0.0094 0.2896
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0021 0.006 0.1353
Echinococcus granulosus chromobox protein 1 0.007 0.032 0.1217
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0012 0.001 0.0034
Schistosoma mansoni calcium-transporting atpase sarcoplasmic/endoplasmic reticulum type (calcium pump) 0.0025 0.0077 0.0292
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0082 0.0294
Echinococcus granulosus calcium transporting atpase 0.0025 0.0077 0.0292
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0237 0.1202 0.1671
Loa Loa (eye worm) MH2 domain-containing protein 0.0236 0.1197 1
Trichomonas vaginalis mercuric reductase, putative 0.0032 0.0119 0.3667
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0032 0.0119 0.2647
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0126 0.1052
Mycobacterium tuberculosis Probable reductase 0.0213 0.1076 0.1495
Toxoplasma gondii Myb family DNA-binding domain-containing protein 0.0047 0.0195 0.0701
Brugia malayi Associated with TFs and helicases family protein 0.0012 0.0008 0.0067
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0209 0.1744
Brugia malayi Probable calcium-transporting ATPase KIAA0703 0.0019 0.0049 0.041
Plasmodium falciparum non-SERCA-type Ca2+ -transporting P-ATPase 0.0028 0.0094 0.2128
Trichomonas vaginalis chromobox protein, putative 0.007 0.032 1
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0032 0.0119 0.2547
Leishmania major calcium-transporting ATPase, putative 0.0013 0.0016 0.0323
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0279 0.1064
Trypanosoma cruzi DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Trypanosoma cruzi DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Schistosoma mansoni terminal deoxycytidyl transferase 0.0038 0.0148 0.0565
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0016 0.0034 0.0992
Echinococcus granulosus Ca2 transporting ATPase plasma membrane 0.0013 0.0016 0.0062
Loa Loa (eye worm) hypothetical protein 0.0012 0.0008 0.0067
Toxoplasma gondii thioredoxin reductase 0.0093 0.0442 0.1589
Leishmania major vacuolar-type Ca2 -ATPase, putative 0.0016 0.0034 0.0716
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0047 0.0194 0.6038
Trypanosoma brucei calcium motive p-type ATPase, putative 0.0013 0.0016 0.0323
Loa Loa (eye worm) Na,K-ATPase alpha subunit 0.0016 0.0034 0.0281
Trypanosoma cruzi trypanothione reductase, putative 0.0032 0.0119 0.2647
Leishmania major P-type ATPase, putative 0.0013 0.0016 0.0323
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.001 0.000000000024135 0.000000000086784
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0008 0.0185
Echinococcus multilocularis Chromobox protein 3 0.0012 0.0008 0.003
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0279 0.1064
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Onchocerca volvulus 0.0031 0.0111 0.6276
Trypanosoma brucei hypothetical protein, conserved 0.0012 0.001 0.0169
Trypanosoma brucei chrX additional, unordered contigs 0.0012 0.001 0.0169
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0008 0.0185
Echinococcus granulosus plasma membrane calcium transporting ATPase 2 0.0016 0.0034 0.0128
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0039 0.0156 0.9031
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0016 0.0034 0.0992
Loa Loa (eye worm) hypothetical protein 0.0031 0.0111 0.0925
Echinococcus multilocularis bloom syndrome protein 0.0024 0.0075 0.0287
Schistosoma mansoni transcription factor LCR-F1 0.0072 0.0328 0.125
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0032 0.0119 0.0451
Mycobacterium ulcerans DNA polymerase IV 0.0038 0.0148 0.0143
Echinococcus multilocularis dna polymerase kappa 0.0038 0.0148 0.0565
Brugia malayi ImpB/MucB/SamB family protein 0.0063 0.0281 0.2351
Trichomonas vaginalis MYB, putative 0.0047 0.0195 0.6075
Schistosoma mansoni hypothetical protein 0.0016 0.003 0.0113
Echinococcus granulosus GPCR family 2 0.0016 0.003 0.0113
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0082 0.1851
Leishmania major trypanothione reductase 0.0093 0.0442 1
Echinococcus granulosus smad 0.0016 0.0032 0.0122
Schistosoma mansoni ATPase 0.0028 0.0094 0.0358
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0047 0.0194 0.5802
Toxoplasma gondii 'chromo' (CHRromatin Organization MOdifier) domain-containing protein 0.0012 0.0008 0.0029
Trypanosoma brucei DNA polymerase IV, putative 0.0038 0.0148 0.3327
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0032 0.0119 0.2647
Trichomonas vaginalis MYB3r3, putative 0.0047 0.0194 0.6038
Trypanosoma brucei DNA damage repair protein, putative 0.0012 0.001 0.0169
Plasmodium falciparum calcium-transporting ATPase 0.0025 0.0077 0.1737
Brugia malayi MH2 domain containing protein 0.0016 0.0032 0.0269
Echinococcus multilocularis chromodomain helicase DNA binding protein 1 0.0012 0.0008 0.003
Brugia malayi ImpB/MucB/SamB family protein 0.0038 0.0148 0.124
Echinococcus granulosus Chromo domain 0.0012 0.0008 0.003
Mycobacterium leprae probable 3-phosphoshikimate 1-carboxyvinyl transferase AroA (5-ENOLPYRUVYLSHIKIMATE-3-PHOSPHATE SYNTHASE) (EPSP SYNTHASE) (EPSPS 0.0535 0.2781 0.3876
Echinococcus granulosus geminin 0.0506 0.2627 1
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0047 0.0194 0.6038
Plasmodium falciparum chromodomain-helicase-DNA-binding protein 1 homolog, putative 0.0012 0.0008 0.0181
Loa Loa (eye worm) hypothetical protein 0.0122 0.0593 0.4957
Brugia malayi SET domain containing protein 0.0012 0.0008 0.0067
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0032 0.0119 0.2647
Echinococcus multilocularis sarco:endoplasmic reticulum calcium ATPase 0.0028 0.0094 0.0358
Trypanosoma brucei DNA polymerase kappa, putative 0.0012 0.001 0.0169
Trichomonas vaginalis hypothetical protein 0.0012 0.0008 0.0185
Brugia malayi Calcium-transporting ATPase sarcoplasmic/endoplasmic reticulum type 0.0025 0.0077 0.0642
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0047 0.0194 0.5802
Loa Loa (eye worm) TAR-binding protein 0.0063 0.0279 0.2336
Loa Loa (eye worm) glutathione reductase 0.0093 0.0442 0.3693
Trypanosoma cruzi DNA damage repair protein, putative 0.0012 0.001 0.0169
Brugia malayi Type III restriction enzyme, res subunit family protein 0.0012 0.0008 0.0067
Trypanosoma brucei DNA polymerase kappa, putative 0.0026 0.0086 0.1905
Schistosoma mansoni calcium-transporting atpase 2 (atpase 2) 0.0025 0.0077 0.0292
Echinococcus multilocularis chromobox protein 1 0.007 0.032 0.1217
Leishmania major DNA polymerase kappa, putative 0.0012 0.001 0.0169
Echinococcus multilocularis calcium transporting atpase 0.0025 0.0077 0.0292
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0032 0.0119 0.2547
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0024 0.0073 0.061
Echinococcus granulosus tar DNA binding protein 0.0063 0.0279 0.1064
Giardia lamblia DNA damage repair protein 0.0012 0.001 0.0488
Plasmodium vivax thioredoxin reductase, putative 0.0093 0.0442 1
Plasmodium falciparum thioredoxin reductase 0.0032 0.0119 0.2682
Trypanosoma cruzi plasma membrane Ca2+ ATPase 0.0016 0.0034 0.0716
Trichomonas vaginalis chromobox protein, putative 0.0012 0.0008 0.0185
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Leishmania major calcium motive p-type ATPase, putative 0.0013 0.0016 0.0323
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0093 0.0442 0.0609
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0047 0.0194 0.6038
Brugia malayi MH1 domain containing protein 0.0016 0.0032 0.0269
Trypanosoma cruzi DNA polymerase kappa, putative 0.0038 0.0148 0.3327
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0008 0.0185
Schistosoma mansoni ATPase 0.0028 0.0094 0.0358
Mycobacterium ulcerans 3-phosphoshikimate 1-carboxyvinyltransferase 0.0535 0.2781 0.2777
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine 1-carboxyvinyltransferase MurA 0.1364 0.7166 1
Trypanosoma brucei calcium-translocating P-type ATPase 0.0025 0.0077 0.1698
Giardia lamblia Plasma membrane calcium-transporting ATPase 2 0.0013 0.0016 0.0836
Echinococcus granulosus calcium transporting ATPase type 2C member 0.0028 0.0094 0.0358
Echinococcus granulosus plasma membrane calcium transporting ATPase 0.0013 0.0016 0.0062
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0042 0.0172 1
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0016 0.0034 0.0992
Plasmodium vivax hypothetical protein, conserved 0.0012 0.0008 0.00000000050353
Echinococcus multilocularis GPCR, family 2 0.0016 0.003 0.0113
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0032 0.0119 0.2647
Brugia malayi MH1 domain containing protein 0.0016 0.0032 0.0269
Toxoplasma gondii P-type ATPase4, putative 0.0016 0.0034 0.0121
Loa Loa (eye worm) sodium/potassium-transporting ATPase subunit alpha 0.0011 0.0006 0.0049
Brugia malayi RNA binding protein 0.0063 0.0279 0.2336
Echinococcus multilocularis Na+:K+ ATPase alpha subunit 0.0013 0.0016 0.0062
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0008 0.00000000068232
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0047 0.0194 0.5802
Schistosoma mansoni chromobox protein 0.007 0.032 0.1217
Trichomonas vaginalis cation-transporting ATPase fungi, putative 0.0016 0.0034 0.0992
Echinococcus multilocularis thioredoxin glutathione reductase 0.0093 0.0442 0.1682
Schistosoma mansoni chromobox protein 0.0012 0.0008 0.003
Schistosoma mansoni Smad4 0.0016 0.0032 0.0122
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0008 0.0185
Plasmodium vivax P-type ATPase4, putative 0.0028 0.0094 0.1984
Trichomonas vaginalis DNA helicase recq, putative 0.0024 0.0075 0.2308
Mycobacterium ulcerans hypothetical protein 0.0012 0.001 0.0004
Mycobacterium ulcerans DNA polymerase IV 0.0038 0.0148 0.0143
Schistosoma mansoni DNA polymerase eta 0.0063 0.0281 0.1071
Schistosoma mansoni hypothetical protein 0.0506 0.2627 1
Toxoplasma gondii chromodomain helicase DNA binding protein CHD1/SWI2/SNF2 0.0012 0.0008 0.0029
Echinococcus granulosus Na:K ATPase alpha subunit 0.0013 0.0016 0.0062
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.0012 0.0008 0.003
Entamoeba histolytica hypothetical protein 0.0072 0.0328 1
Leishmania major DNA polymerase eta, putative 0.0037 0.0142 0.3191
Leishmania major DNA damage repair protein, putative 0.0012 0.001 0.0169
Loa Loa (eye worm) hypothetical protein 0.0034 0.0126 0.1052
Brugia malayi Sodium/potassium-transporting ATPase alpha chain, putative 0.0011 0.0006 0.0049
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0047 0.0195 0.6075

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) 0 Inhibition of thrombin-induced platelet aggregation in human platelets after 5 mins by turbidimetric method ChEMBL. 18031002
IC50 (binding) = 2 mM Inhibition of PDE3 in guinea pig ventricle ChEMBL. 18031002
IC50 (functional) = 45 uM The antiplatelet activity was tested by the turbidimetric method in washed human platelets using thrombin as agonist. ChEMBL. 14698150
IC50 (functional) = 45 uM Tested for anti-platelet activity by turbidimetric method using thrombin as agonist in washed platelet ChEMBL. 12039565
IC50 (functional) = 45 uM Inhibition of thrombin-induced platelet aggregation in human platelets after 5 mins by turbidimetric method ChEMBL. 18031002
IC50 (functional) = 45 uM The antiplatelet activity was tested by the turbidimetric method in washed human platelets using thrombin as agonist. ChEMBL. 14698150

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.
 
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External resources for this compound

Bibliographic References

3 literature references were collected for this gene.

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