Detailed information for compound 1622056

Basic information

Technical information
  • TDR Targets ID: 1622056
  • Name: (8E)-4-(2-chlorophenyl)-8-[(2-chlorophenyl)me thylidene]-6-methyl-3,4,5,7-tetrahydro-1H-pyr ido[3,4-e]pyrimidine-2-thione hydrochloride
  • MW: 452.828 | Formula: C21H20Cl3N3S
  • H donors: 1 H acceptors: 0 LogP: 4.82 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN1C/C(=C\c2ccccc2Cl)/C2=C(C1)C(NC(=N2)S)c1ccccc1Cl.Cl
  • InChi: 1S/C21H19Cl2N3S.ClH/c1-26-11-14(10-13-6-2-4-8-17(13)22)19-16(12-26)20(25-21(27)24-19)15-7-3-5-9-18(15)23;/h2-10,20H,11-12H2,1H3,(H2,24,25,27);1H/b14-10+;
  • InChiKey: USZHGDCXYCZTFP-KMZJGFRYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (8E)-4-(2-chlorophenyl)-8-[(2-chlorophenyl)methylene]-6-methyl-3,4,5,7-tetrahydro-1H-pyrido[3,4-e]pyrimidine-2-thione hydrochloride
  • (8E)-8-(2-chlorobenzylidene)-4-(2-chlorophenyl)-6-methyl-3,4,5,7-tetrahydro-1H-pyrido[3,4-e]pyrimidine-2-thione hydrochloride
  • NSC669443

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
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0149 0.0067 0.0069
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.4657 0.3774 0.3774
Mycobacterium ulcerans acetyl-/propionyl-CoA carboxylase subunit beta 0.1657 0.1306 0.3372
Plasmodium falciparum lipoamide acyltransferase component of branched-chain alpha-keto acid dehydrogenase complex 0.0428 0.0296 0.0391
Brugia malayi hypothetical protein 0.0086 0.0014 0.0015
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0149 0.0067 0.0067
Trichomonas vaginalis set domain proteins, putative 0.0762 0.057 1
Leishmania major dihydrolipoamide acetyltransferase precursor, putative 0.0428 0.0296 0.0246
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0216 0.0122 0.0126
Mycobacterium ulcerans acetyl/propionyl CoA carboxylase subunit beta 0.1657 0.1306 0.3372
Trypanosoma cruzi 2-oxoglutarate dehydrogenase, E2 component, dihydrolipoamide succinyltransferase, putative 0.0428 0.0296 0.0366
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0096 0.0023 0.0023
Trypanosoma brucei glutamine hydrolysing (not ammonia-dependent) carbomoyl phosphate synthase, putative 0.1053 0.0809 0.0742
Brugia malayi Dihydrolipoyllysine-residue succinyltransferase component of 2-oxoglutarate dehydrogenase complex, mitochondrial precursor, puta 0.0428 0.0296 0.0307
Mycobacterium tuberculosis Probable branched-chain keto acid dehydrogenase E2 component BkdC 0.0428 0.0296 0.0658
Schistosoma mansoni rab6-interacting 0.0086 0.0014 0.0014
Echinococcus granulosus lysosomal alpha glucosidase 0.0707 0.0525 0.0525
Loa Loa (eye worm) glutaminase 0.06 0.0437 0.0453
Mycobacterium ulcerans hypothetical protein 0.0428 0.0296 0.0658
Mycobacterium ulcerans acetyl-coenzyme a carboxylase carboxyl transferase (subunit beta) AccD3 0.1657 0.1306 0.3372
Leishmania major methylcrotonoyl-coa carboxylase biotinylated subunitprotein-like protein 0.4657 0.3774 0.3742
Plasmodium vivax carbamoyl phosphate synthetase, putative 0.1053 0.0809 0.1104
Onchocerca volvulus 0.0096 0.0023 0.0155
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0096 0.0023 0.0023
Brugia malayi Pre-SET motif family protein 0.0669 0.0494 0.0512
Plasmodium vivax lipoamide acyltransferase component of branched-chain alpha-keto acid dehydrogenase complex, putative 0.0428 0.0296 0.0391
Trypanosoma cruzi 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.1657 0.1306 0.2024
Plasmodium falciparum dihydrolipoamide acyltransferase component E2 0.0428 0.0296 0.0391
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0669 0.0494 0.0512
Brugia malayi latrophilin 2 splice variant baaae 0.0148 0.0065 0.0068
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0096 0.0023 0.0023
Leishmania major carbamoyl-phosphate synthase, putative 0.1053 0.0809 0.0763
Leishmania major dihydrolipoamide acetyltransferase precursorlike protein 0.0428 0.0296 0.0246
Trypanosoma brucei unspecified product 0.3062 0.2462 0.2407
Onchocerca volvulus 0.0409 0.028 0.478
Loa Loa (eye worm) hypothetical protein 0.0428 0.0296 0.0307
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.4657 0.3774 0.6071
Leishmania major dihydrolipoamide branched chain transacylase, putative 0.0428 0.0296 0.0246
Mycobacterium ulcerans branched-chain alpha-keto acid dehydrogenase subunit E2 0.0428 0.0296 0.0658
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0512 0.0365 0.0365
Brugia malayi Doublecortin family protein 0.0086 0.0014 0.0015
Mycobacterium leprae Probable propionyl-CoA carboxylase beta chain 5 AccD5 (PCCASE) (PROPANOYL-COA:CARBON DIOXIDE LIGASE) 0.1657 0.1306 0.2905
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 4 AccD4_2 0.1657 0.1306 0.3372
Plasmodium vivax dihydrolipoyllysine-residue succinyltransferase component of 2-oxoglutarate dehydrogenase complex, putative 0.0428 0.0296 0.0391
Echinococcus multilocularis lipoxygenase domain containing protein 0.0086 0.0014 0.0014
Schistosoma mansoni lipoxygenase 0.0512 0.0365 0.0365
Plasmodium vivax biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.8848 0.7221 1
Schistosoma mansoni hypothetical protein 0.0182 0.0093 0.0093
Leishmania major 2-oxoglutarate dehydrogenase, E2 component, dihydrolipoamide succinyltransferase, putative 0.0428 0.0296 0.0246
Schistosoma mansoni aldehyde dehydrogenase 0.013 0.0051 0.0051
Loa Loa (eye worm) hypothetical protein 0.0253 0.0152 0.0158
Loa Loa (eye worm) RNA binding protein 0.0136 0.0055 0.0057
Echinococcus granulosus propionyl coenzyme A carboxylase beta chain 0.1657 0.1306 0.1306
Echinococcus multilocularis lysosomal alpha glucosidase 0.0707 0.0525 0.0525
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0216 0.0122 0.0126
Toxoplasma gondii aldehyde dehydrogenase 0.013 0.0051 0.0028
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0707 0.0525 0.0544
Loa Loa (eye worm) doublecortin family protein 0.0086 0.0014 0.0015
Trypanosoma brucei 3-methylcrotonyl-CoA carboxylase alpha subunit, putative 0.4657 0.3774 0.3729
Brugia malayi Carboxyl transferase domain containing protein 1.1798 0.9648 1
Echinococcus multilocularis neuropeptide receptor A26 0.0519 0.0371 0.0371
Schistosoma mansoni hypothetical protein 0.0086 0.0014 0.0014
Brugia malayi RNA recognition motif domain containing protein 0.0136 0.0055 0.0057
Schistosoma mansoni tar DNA-binding protein 0.0136 0.0055 0.0055
Schistosoma mansoni aldehyde dehydrogenase 0.013 0.0051 0.0051
Brugia malayi Calcitonin receptor-like protein seb-1 0.0216 0.0122 0.0126
Brugia malayi TAR-binding protein 0.0136 0.0055 0.0057
Echinococcus multilocularis lipoxygenase domain containing protein 0.0086 0.0014 0.0014
Schistosoma mansoni hypothetical protein 0.0148 0.0065 0.0065
Trypanosoma brucei dihydrolipoamide acetyltransferase E2 subunit, putative 0.0428 0.0296 0.0225
Schistosoma mansoni alpha-glucosidase 0.0608 0.0444 0.0444
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E2 0.0428 0.0296 0.0274
Schistosoma mansoni lipoxygenase 0.0358 0.0238 0.0238
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.4657 0.3774 0.3774
Mycobacterium ulcerans glutaminase 0.06 0.0437 0.1037
Toxoplasma gondii biotin-requiring enzyme domain-containing protein 0.0428 0.0296 0.0274
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.013 0.0051 0.0051
Mycobacterium tuberculosis Probable propionyl-CoA carboxylase beta chain 5 AccD5 (pccase) (propanoyl-CoA:carbon dioxide ligase) 0.1657 0.1306 0.3372
Brugia malayi Glycosyl hydrolases family 31 protein 0.0157 0.0073 0.0075
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0149 0.0067 0.0067
Trypanosoma cruzi dihydrolipoamide branched chain transacylase, putative 0.0428 0.0296 0.0366
Treponema pallidum pyruvate carboxylase subunit B 0.0428 0.0296 0.5
Mycobacterium leprae Probable bifunctional protein acetyl-/propionyl-coenzyme A carboxylase, alpha chain AccA3 (BccP) 0.4657 0.3774 1
Trypanosoma brucei acetyl-CoA carboxylase 1.2227 1 1
Mycobacterium tuberculosis Probable pyruvate carboxylase Pca (pyruvic carboxylase) 0.4657 0.3774 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0707 0.0525 0.0544
Schistosoma mansoni propionyl-CoA carboxylase beta chain mitochondrial precursor 0.1657 0.1306 0.1306
Schistosoma mansoni loxhd1 0.0086 0.0014 0.0014
Loa Loa (eye worm) glutaminase 2 0.06 0.0437 0.0453
Entamoeba histolytica acetyl-coA carboxylase, putative 0.2085 0.1659 1
Loa Loa (eye worm) hypothetical protein 0.0086 0.0014 0.0015
Mycobacterium tuberculosis Biotinylated protein TB7.3 0.0428 0.0296 0.0658
Echinococcus multilocularis neuropeptide s receptor 0.0519 0.0371 0.0371
Trypanosoma cruzi dihydrolipoamide acetyltransferase, putative 0.0428 0.0296 0.0366
Echinococcus multilocularis geminin 0.0182 0.0093 0.0093
Loa Loa (eye worm) hypothetical protein 0.0428 0.0296 0.0307
Schistosoma mansoni dihydrolipoamide acetyltransferase component of pyruvate dehydrogenase 0.0428 0.0296 0.0296
Echinococcus granulosus dihydrolipoyllysine residue acetyltransferase 0.0428 0.0296 0.0296
Echinococcus granulosus Biotin lipoyl attachment 0.0428 0.0296 0.0296
Brugia malayi RNA binding protein 0.0136 0.0055 0.0057
Toxoplasma gondii pyruvate carboxylase 0.4657 0.3774 0.376
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0096 0.0023 0.0023
Brugia malayi Pre-SET motif family protein 0.0096 0.0023 0.0024
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 4 AccD4 0.1657 0.1306 0.3372
Trypanosoma cruzi glutamine dependent carbamoyl-phosphate synthase, putative 0.1053 0.0809 0.1208
Mycobacterium ulcerans dihydrolipoamide acetyltransferase 0.0428 0.0296 0.0658
Trypanosoma brucei pyruvate dehydrogenase complex E3 binding protein, putative 0.0428 0.0296 0.0225
Giardia lamblia Acetyl-CoA carboxylase/pyruvate carboxylase fusion protein, putative 0.2085 0.1659 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0149 0.0067 0.0067
Echinococcus granulosus Polycystic kidney disease protein 0.0086 0.0014 0.0014
Echinococcus multilocularis acetyl coenzyme A carboxylase 1 1.2227 1 1
Schistosoma mansoni dihydrolipoamide acetyltransferase component of pyruvate dehydrogenase 0.0428 0.0296 0.0296
Echinococcus multilocularis propionyl coenzyme A carboxylase beta chain 0.1657 0.1306 0.1306
Loa Loa (eye worm) hypothetical protein 0.0086 0.0014 0.0015
Schistosoma mansoni tar DNA-binding protein 0.0136 0.0055 0.0055
Leishmania major acetyl-CoA carboxylase, putative 1.2227 1 1
Echinococcus granulosus survival motor neuron protein 1 0.0253 0.0152 0.0152
Trypanosoma cruzi 2-oxoglutarate dehydrogenase, E2 component, dihydrolipoamide succinyltransferase, putative 0.0428 0.0296 0.0366
Schistosoma mansoni tar DNA-binding protein 0.0136 0.0055 0.0055
Brugia malayi Lipoamide acyltransferase component of branched-chain alpha-keto aciddehydrogenase complex, mitochondrial precursor 0.0428 0.0296 0.0307
Echinococcus multilocularis propionyl coenzyme A carboxylase alpha chain 0.4657 0.3774 0.3774
Chlamydia trachomatis acetyl-coenzyme A carboxylase carboxyl transferase subunit beta 0.1657 0.1306 0.3233
Echinococcus granulosus neutral alpha glucosidase AB 0.0157 0.0073 0.0073
Brugia malayi hypothetical protein 0.0253 0.0152 0.0158
Schistosoma mansoni tar DNA-binding protein 0.0136 0.0055 0.0055
Trypanosoma cruzi acetyl-CoA carboxylase, putative 0.1657 0.1306 0.2024
Schistosoma mansoni dihydrolipoamide succinyltransferase component of 2-oxoglutarate dehydrogenase 0.0428 0.0296 0.0296
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0149 0.0067 0.0067
Schistosoma mansoni glutaminase 0.06 0.0437 0.0437
Mycobacterium ulcerans carbamoyl phosphate synthase large subunit 0.1053 0.0809 0.2038
Mycobacterium ulcerans pyruvate carboxylase 0.4657 0.3774 1
Trichomonas vaginalis glutaminase, putative 0.06 0.0437 0.7324
Plasmodium falciparum dihydrolipoyllysine-residue succinyltransferase component of 2-oxoglutarate dehydrogenase complex 0.0428 0.0296 0.0391
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0512 0.0365 0.0365
Schistosoma mansoni dihydrolipoamide S-acetyltransferase 0.0428 0.0296 0.0296
Echinococcus granulosus propionyl coenzyme A carboxylase alpha chain 0.4657 0.3774 0.3774
Brugia malayi glutaminase DH11.1 0.06 0.0437 0.0453
Echinococcus multilocularis lysosomal alpha glucosidase 0.0707 0.0525 0.0525
Echinococcus granulosus dihydrolipoyllysine residue succinyltransferase 0.0428 0.0296 0.0296
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.013 0.0051 0.0051
Plasmodium falciparum carbamoyl phosphate synthetase 0.1053 0.0809 0.1104
Onchocerca volvulus 0.0762 0.057 1
Schistosoma mansoni hypothetical protein 0.0182 0.0093 0.0093
Loa Loa (eye worm) carboxyl transferase domain-containing protein 1.1798 0.9648 1
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0157 0.0073 0.0075
Mycobacterium ulcerans bifunctional protein acetyl-/propionyl-coenzyme a carboxylase (alpha chain) AccA3 0.4657 0.3774 1
Plasmodium vivax SET domain protein, putative 0.0096 0.0023 0.0012
Leishmania major alpha glucosidase II subunit, putative 0.0157 0.0073 0.0022
Schistosoma mansoni rab6-interacting 0.0086 0.0014 0.0014
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0092 0.002 0.002
Brugia malayi dihydrolipoamide S-acetyltransferase precursor, putative 0.0428 0.0296 0.0307
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.4657 0.3774 0.6071
Trypanosoma cruzi acetyl-CoA carboxylase 0.7569 0.617 1
Mycobacterium tuberculosis Probable acetyl-/propionyl-coenzyme A carboxylase alpha chain (alpha subunit) AccA2: biotin carboxylase + biotin carboxyl carrie 0.4657 0.3774 1
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0157 0.0073 0.005
Toxoplasma gondii acetyl-coA carboxylase ACC2 1.2227 1 1
Schistosoma mansoni pyruvate carboxylase 0.4657 0.3774 0.3774
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0096 0.0023 0.0023
Toxoplasma gondii 2-oxo acid dehydrogenases acyltransferase (catalytic domain) domain-containing protein 0.0428 0.0296 0.0274
Schistosoma mansoni carbamoyl-phosphate synthetase 0.1053 0.0809 0.0809
Toxoplasma gondii dihydrolipoyllysine-residue succinyltransferase component of oxoglutarate dehydrogenase 0.0428 0.0296 0.0274
Trypanosoma cruzi 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.1657 0.1306 0.2024
Mycobacterium leprae Probable propyonyl-CoA carboxylase beta chain 4 AccD4 (Pccase) 0.1657 0.1306 0.2905
Echinococcus granulosus neuropeptide s receptor 0.0519 0.0371 0.0371
Trypanosoma brucei 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.1657 0.1306 0.1243
Wolbachia endosymbiont of Brugia malayi Acetyl/propionyl-CoA carboxylase, alpha subunit 0.4657 0.3774 1
Mycobacterium tuberculosis Acetyl/propionyl-CoA carboxylase (beta subunit) AccD6 0.1657 0.1306 0.3372
Trypanosoma cruzi dihydrolipoamide branched chain transacylase, putative 0.0428 0.0296 0.0366
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0149 0.0067 0.0067
Trypanosoma cruzi dihydrolipoamide acetyltransferase precursor, putative 0.0428 0.0296 0.0366
Loa Loa (eye worm) hypothetical protein 0.0428 0.0296 0.0307
Wolbachia endosymbiont of Brugia malayi carbamoyl phosphate synthase large subunit 0.1053 0.0809 0.1476
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 5 AccD5 0.1657 0.1306 0.3372
Echinococcus granulosus tar DNA binding protein 0.0136 0.0055 0.0055
Echinococcus granulosus lipoxygenase domain containing protein 0.0086 0.0014 0.0014
Trypanosoma brucei dihydrolipoamide branched chain transacylase, putative 0.0428 0.0296 0.0225
Echinococcus multilocularis neutral alpha glucosidase AB 0.0157 0.0073 0.0073
Trypanosoma cruzi glutamine-dependent carbamoyl-phosphate synthetase, putative 0.1053 0.0809 0.1208
Echinococcus granulosus histone lysine methyltransferase setb 0.0096 0.0023 0.0023
Loa Loa (eye worm) hypothetical protein 0.0096 0.0023 0.0024
Mycobacterium tuberculosis DlaT, dihydrolipoamide acyltransferase, E2 component of pyruvate dehydrogenase 0.0428 0.0296 0.0658
Schistosoma mansoni aspartate carbamoyltransferase 0.1053 0.0809 0.0809
Schistosoma mansoni polycystin 1-related 0.0086 0.0014 0.0014
Brugia malayi hypothetical protein 0.0086 0.0014 0.0015
Echinococcus multilocularis dihydrolipoyllysine residue acetyltransferase 0.0428 0.0296 0.0296
Schistosoma mansoni alpha-glucosidase 0.0608 0.0444 0.0444
Loa Loa (eye worm) hypothetical protein 0.0148 0.0065 0.0068
Toxoplasma gondii dihydrolipoamide acyltransferase, putative 0.0428 0.0296 0.0274
Echinococcus granulosus geminin 0.0182 0.0093 0.0093
Leishmania major carboxylase, putative 0.4657 0.3774 0.3742
Loa Loa (eye worm) TAR-binding protein 0.0136 0.0055 0.0057
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0136 0.0055 0.0057
Mycobacterium ulcerans acetyl-/propionyl-coenzyme a carboxylase alpha chain, AccA2 0.4657 0.3774 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0149 0.0067 0.0067
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0149 0.0067 0.0069
Plasmodium falciparum biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.8848 0.7221 1
Echinococcus multilocularis Biotin lipoyl attachment 0.0428 0.0296 0.0296
Leishmania major propionyl-coa carboxylase beta chain, putative 0.1657 0.1306 0.1262
Mycobacterium leprae ACETYL/PROPIONYL-CoA CARBOXYLASE (BETA SUBUNIT) ACCD6 0.1657 0.1306 0.2905
Mycobacterium ulcerans acetyl-/propionyl-coenzyme a carboxylase alpha chain AccA1 0.4657 0.3774 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0149 0.0067 0.0067
Echinococcus multilocularis dihydrolipoyllysine residue succinyltransferase 0.0428 0.0296 0.0296
Schistosoma mansoni tar DNA-binding protein 0.0136 0.0055 0.0055
Leishmania major 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.1657 0.1306 0.1262
Echinococcus multilocularis tar DNA binding protein 0.0136 0.0055 0.0055
Echinococcus granulosus lipoxygenase domain containing protein 0.0086 0.0014 0.0014
Trypanosoma brucei 3-methylcrotonyl-CoA carboxylase alpha subunit, putative 0.4657 0.3774 0.3729
Schistosoma mansoni carbamoyl-phosphate synthetase 0.1053 0.0809 0.0809
Toxoplasma gondii acyl-CoA carboxyltransferase beta chain, putative 0.1657 0.1306 0.1287
Toxoplasma gondii acetyl-CoA carboxylase ACC1 1.2227 1 1
Echinococcus granulosus RUN 0.0086 0.0014 0.0014
Loa Loa (eye worm) hypothetical protein 0.0216 0.0122 0.0126
Echinococcus multilocularis survival motor neuron protein 1 0.0253 0.0152 0.0152
Echinococcus multilocularis Polycystic kidney disease protein 0.0086 0.0014 0.0014
Chlamydia trachomatis biotin carboxylase 0.4229 0.3422 1
Toxoplasma gondii carbamoylphosphate synthetase 0.1053 0.0809 0.0789
Schistosoma mansoni acetyl-CoA carboxylase 1.2227 1 1
Trypanosoma cruzi dihydrolipoamide acetyltransferase precursor, putative 0.0428 0.0296 0.0366
Echinococcus granulosus neuropeptide receptor A26 0.0519 0.0371 0.0371
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0096 0.0023 0.0023
Echinococcus multilocularis RUN 0.0086 0.0014 0.0014
Trypanosoma brucei 2-oxoglutarate dehydrogenase E2 component, putative 0.0428 0.0296 0.0225
Wolbachia endosymbiont of Brugia malayi Acetyl-CoA carboxylase, carboxyltransferase component 0.1657 0.1306 0.2905
Schistosoma mansoni alpha glucosidase 0.0157 0.0073 0.0073

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -5.419 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.912 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
GI50 (functional) -4.662 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) -4.601 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) -4.592 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) -4.586 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.365 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) -4.335 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.22 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) -4.133 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) -4.118 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

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

No literature references available for this target.

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