Detailed information for compound 1628054

Basic information

Technical information
  • TDR Targets ID: 1628054
  • Name: 1-[(2-methylcyclohexylidene)amino]-3-(4-methy lphenyl)thiourea
  • MW: 275.412 | Formula: C15H21N3S
  • H donors: 2 H acceptors: 0 LogP: 3.65 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: S=C(Nc1ccc(cc1)C)N/N=C/1\CCCCC1C
  • InChi: 1S/C15H21N3S/c1-11-7-9-13(10-8-11)16-15(19)18-17-14-6-4-3-5-12(14)2/h7-10,12H,3-6H2,1-2H3,(H2,16,18,19)/b17-14+
  • InChiKey: OZBSRQUCTJBHSD-SAPNQHFASA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • T0509-9705

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens bromodomain adjacent to zinc finger domain, 2B Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references
Homo sapiens glucosidase, alpha Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Brugia malayi Glycosyl hydrolases family 31 protein Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma mansoni alpha-glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Echinococcus granulosus lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma mansoni alpha-glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum Conserved hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Onchocerca volvulus Get druggable targets OG5_127055 All targets in OG5_127055
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Schistosoma mansoni bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Candida albicans cell wall mannoprotein glycosyl hydrolase whose expression increases in presence of galatose Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum Lysosomal alpha-glucosidase precursor, putative Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum ko:K01549 ATP synthase [EC3.6.3.14], putative Get druggable targets OG5_131570 All targets in OG5_131570
Echinococcus multilocularis lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Echinococcus multilocularis bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Candida albicans cell wall mannoprotein glycosyl hydrolase whose expression increases in presence of galatose Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum expressed protein Get druggable targets OG5_131570 All targets in OG5_131570
Candida albicans closely related to C. albicans GCA1 cell wall mannoprotein glycosyl hydrolase Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Brugia malayi Bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Echinococcus multilocularis lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans closely related to C. albicans GCA1 cell wall mannoprotein glycosyl hydrolase Get druggable targets OG5_127055 All targets in OG5_127055
Loa Loa (eye worm) glycosyl hydrolase family 31 protein Get druggable targets OG5_127055 All targets in OG5_127055
Echinococcus granulosus bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum Cleft lip and palate transmembrane protein 1-like protein, putative Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum ko:K01187 alpha-glucosidase [EC3.2.1.20], putative Get druggable targets OG5_127055 All targets in OG5_127055
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma cruzi dihydrolipoamide branched chain transacylase, putative 0.0153 0.0253 0.0411
Trypanosoma cruzi dihydrolipoamide acetyltransferase precursor, putative 0.0153 0.0253 0.0411
Wolbachia endosymbiont of Brugia malayi Acetyl-CoA carboxylase, carboxyltransferase component 0.0591 0.1268 0.2905
Leishmania major carbamoyl-phosphate synthase, putative 0.0376 0.0769 0.0769
Trypanosoma cruzi glutamine dependent carbamoyl-phosphate synthase, putative 0.0376 0.0769 0.1249
Echinococcus multilocularis acetyl coenzyme A carboxylase 1 0.4363 1 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0057 0.0031 0.0031
Mycobacterium tuberculosis Probable propionyl-CoA carboxylase beta chain 5 AccD5 (pccase) (propanoyl-CoA:carbon dioxide ligase) 0.0591 0.1268 0.2905
Trypanosoma brucei 3-methylcrotonyl-CoA carboxylase alpha subunit, putative 0.1662 0.3747 0.3746
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0057 0.0031 0.0031
Mycobacterium ulcerans acetyl/propionyl CoA carboxylase subunit beta 0.0591 0.1268 0.2905
Brugia malayi Glycosyl hydrolases family 31 protein 0.0197 0.0355 0.0368
Schistosoma mansoni carbamoyl-phosphate synthetase 0.0376 0.0769 0.0769
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0197 0.0355 0.0367
Leishmania major carboxylase, putative 0.1662 0.3747 0.3746
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0057 0.0031 0.0031
Toxoplasma gondii 2-oxo acid dehydrogenases acyltransferase (catalytic domain) domain-containing protein 0.0153 0.0253 0.0253
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0057 0.0031 0.0031
Leishmania major acetyl-CoA carboxylase, putative 0.4363 1 1
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.1829 0.1829
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.1662 0.3747 0.3747
Trypanosoma brucei unspecified product 0.1093 0.2429 0.2428
Mycobacterium leprae Probable propyonyl-CoA carboxylase beta chain 4 AccD4 (Pccase) 0.0591 0.1268 0.2905
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0072 0.0066 0.0066
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.1662 0.3747 0.6089
Echinococcus granulosus dihydrolipoyllysine residue acetyltransferase 0.0153 0.0253 0.0253
Echinococcus granulosus lysosomal alpha glucosidase 0.0197 0.0355 0.0355
Chlamydia trachomatis biotin carboxylase 0.1509 0.3393 1
Leishmania major dihydrolipoamide acetyltransferase precursorlike protein 0.0153 0.0253 0.0253
Loa Loa (eye worm) hypothetical protein 0.0153 0.0253 0.0262
Schistosoma mansoni dihydrolipoamide acetyltransferase component of pyruvate dehydrogenase 0.0153 0.0253 0.0253
Mycobacterium ulcerans acetyl-/propionyl-coenzyme a carboxylase alpha chain AccA1 0.1662 0.3747 1
Trypanosoma brucei 2-oxoglutarate dehydrogenase E2 component, putative 0.0153 0.0253 0.0253
Wolbachia endosymbiont of Brugia malayi carbamoyl phosphate synthase large subunit 0.0376 0.0769 0.1476
Schistosoma mansoni acetyl-CoA carboxylase 0.4363 1 1
Echinococcus multilocularis neutral alpha glucosidase AB 0.0044 0.0001 0.0001
Mycobacterium ulcerans acetyl-/propionyl-CoA carboxylase subunit beta 0.0591 0.1268 0.2905
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 4 AccD4 0.0591 0.1268 0.2905
Mycobacterium ulcerans bifunctional protein acetyl-/propionyl-coenzyme a carboxylase (alpha chain) AccA3 0.1662 0.3747 1
Mycobacterium tuberculosis Probable acetyl-/propionyl-coenzyme A carboxylase alpha chain (alpha subunit) AccA2: biotin carboxylase + biotin carboxyl carrie 0.1662 0.3747 1
Echinococcus granulosus dihydrolipoyllysine residue succinyltransferase 0.0153 0.0253 0.0253
Onchocerca volvulus 0.0286 0.0562 1
Trypanosoma brucei 3-methylcrotonyl-CoA carboxylase alpha subunit, putative 0.1662 0.3747 0.3746
Trypanosoma cruzi acetyl-CoA carboxylase 0.2701 0.6153 1
Loa Loa (eye worm) hypothetical protein 0.0085 0.0097 0.01
Toxoplasma gondii dihydrolipoyllysine-residue succinyltransferase component of oxoglutarate dehydrogenase 0.0153 0.0253 0.0253
Toxoplasma gondii acetyl-coA carboxylase ACC2 0.4363 1 1
Mycobacterium leprae Probable bifunctional protein acetyl-/propionyl-coenzyme A carboxylase, alpha chain AccA3 (BccP) 0.1662 0.3747 1
Entamoeba histolytica acetyl-coA carboxylase, putative 0.0744 0.1622 1
Leishmania major 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0591 0.1268 0.1268
Echinococcus granulosus Biotin lipoyl attachment 0.0153 0.0253 0.0253
Loa Loa (eye worm) hypothetical protein 0.0052 0.0019 0.0019
Toxoplasma gondii biotin-requiring enzyme domain-containing protein 0.0153 0.0253 0.0253
Brugia malayi Glycosyl hydrolases family 31 protein 0.0044 0.0001 0.0001
Brugia malayi dihydrolipoamide S-acetyltransferase precursor, putative 0.0153 0.0253 0.0263
Schistosoma mansoni dihydrolipoamide S-acetyltransferase 0.0153 0.0253 0.0253
Schistosoma mansoni dihydrolipoamide acetyltransferase component of pyruvate dehydrogenase 0.0153 0.0253 0.0253
Loa Loa (eye worm) hypothetical protein 0.0057 0.0031 0.0031
Echinococcus multilocularis propionyl coenzyme A carboxylase alpha chain 0.1662 0.3747 0.3747
Mycobacterium tuberculosis Acetyl/propionyl-CoA carboxylase (beta subunit) AccD6 0.0591 0.1268 0.2905
Schistosoma mansoni pyruvate carboxylase 0.1662 0.3747 0.3747
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0044 0.0001 0.0003
Loa Loa (eye worm) hypothetical protein 0.0049 0.0013 0.0013
Brugia malayi Bromodomain containing protein 0.0046 0.0007 0.0007
Mycobacterium ulcerans carbamoyl phosphate synthase large subunit 0.0376 0.0769 0.1476
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 5 AccD5 0.0591 0.1268 0.2905
Toxoplasma gondii carbamoylphosphate synthetase 0.0376 0.0769 0.0769
Toxoplasma gondii dihydrolipoamide acyltransferase, putative 0.0153 0.0253 0.0253
Trypanosoma cruzi 2-oxoglutarate dehydrogenase, E2 component, dihydrolipoamide succinyltransferase, putative 0.0153 0.0253 0.0411
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E2 0.0153 0.0253 0.0253
Echinococcus granulosus microtubule associated protein 2 0.0833 0.1829 0.1829
Trypanosoma brucei glutamine hydrolysing (not ammonia-dependent) carbomoyl phosphate synthase, putative 0.0376 0.0769 0.0769
Echinococcus multilocularis dihydrolipoyllysine residue succinyltransferase 0.0153 0.0253 0.0253
Trypanosoma brucei dihydrolipoamide acetyltransferase E2 subunit, putative 0.0153 0.0253 0.0253
Mycobacterium ulcerans acetyl-/propionyl-coenzyme a carboxylase alpha chain, AccA2 0.1662 0.3747 1
Giardia lamblia Acetyl-CoA carboxylase/pyruvate carboxylase fusion protein, putative 0.0744 0.1622 0.5
Echinococcus granulosus propionyl coenzyme A carboxylase beta chain 0.0591 0.1268 0.1268
Trypanosoma cruzi glutamine-dependent carbamoyl-phosphate synthetase, putative 0.0376 0.0769 0.1249
Trichomonas vaginalis set domain proteins, putative 0.0286 0.0562 1
Plasmodium falciparum biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.3158 0.7209 1
Wolbachia endosymbiont of Brugia malayi Acetyl/propionyl-CoA carboxylase, alpha subunit 0.1662 0.3747 1
Schistosoma mansoni alpha-glucosidase 0.0169 0.0292 0.0291
Schistosoma mansoni dihydrolipoamide succinyltransferase component of 2-oxoglutarate dehydrogenase 0.0153 0.0253 0.0253
Brugia malayi Dihydrolipoyllysine-residue succinyltransferase component of 2-oxoglutarate dehydrogenase complex, mitochondrial precursor, puta 0.0153 0.0253 0.0263
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.1662 0.3747 0.3747
Loa Loa (eye worm) hypothetical protein 0.0046 0.0007 0.0006
Trypanosoma cruzi acetyl-CoA carboxylase, putative 0.0591 0.1268 0.2061
Toxoplasma gondii acyl-CoA carboxyltransferase beta chain, putative 0.0591 0.1268 0.1268
Brugia malayi Lipoamide acyltransferase component of branched-chain alpha-keto aciddehydrogenase complex, mitochondrial precursor 0.0153 0.0253 0.0263
Mycobacterium tuberculosis Probable pyruvate carboxylase Pca (pyruvic carboxylase) 0.1662 0.3747 1
Leishmania major methylcrotonoyl-coa carboxylase biotinylated subunitprotein-like protein 0.1662 0.3747 0.3746
Echinococcus granulosus propionyl coenzyme A carboxylase alpha chain 0.1662 0.3747 0.3747
Trypanosoma brucei dihydrolipoamide branched chain transacylase, putative 0.0153 0.0253 0.0253
Echinococcus multilocularis lysosomal alpha glucosidase 0.0197 0.0355 0.0355
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 4 AccD4_2 0.0591 0.1268 0.2905
Plasmodium vivax carbamoyl phosphate synthetase, putative 0.0376 0.0769 0.0742
Leishmania major 2-oxoglutarate dehydrogenase, E2 component, dihydrolipoamide succinyltransferase, putative 0.0153 0.0253 0.0253
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.1662 0.3747 0.6089
Echinococcus granulosus neutral alpha glucosidase AB 0.0044 0.0001 0.0001
Trypanosoma brucei acetyl-CoA carboxylase 0.4363 1 1
Trypanosoma brucei 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0591 0.1268 0.1268
Loa Loa (eye worm) hypothetical protein 0.0153 0.0253 0.0262
Mycobacterium ulcerans acetyl-coenzyme a carboxylase carboxyl transferase (subunit beta) AccD3 0.0591 0.1268 0.2905
Chlamydia trachomatis acetyl-coenzyme A carboxylase carboxyl transferase subunit beta 0.0591 0.1268 0.3233
Toxoplasma gondii pyruvate carboxylase 0.1662 0.3747 0.3746
Loa Loa (eye worm) carboxyl transferase domain-containing protein 0.421 0.9646 1
Echinococcus multilocularis Biotin lipoyl attachment 0.0153 0.0253 0.0253
Trypanosoma cruzi dihydrolipoamide branched chain transacylase, putative 0.0153 0.0253 0.0411
Trypanosoma cruzi 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0591 0.1268 0.2061
Leishmania major propionyl-coa carboxylase beta chain, putative 0.0591 0.1268 0.1268
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0072 0.0066 0.0066
Echinococcus multilocularis propionyl coenzyme A carboxylase beta chain 0.0591 0.1268 0.1268
Echinococcus multilocularis lysosomal alpha glucosidase 0.0197 0.0355 0.0355
Leishmania major dihydrolipoamide branched chain transacylase, putative 0.0153 0.0253 0.0253
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.1829 0.1829
Treponema pallidum pyruvate carboxylase subunit B 0.0153 0.0253 0.5
Schistosoma mansoni aspartate carbamoyltransferase 0.0376 0.0769 0.0769
Trypanosoma cruzi dihydrolipoamide acetyltransferase precursor, putative 0.0153 0.0253 0.0411
Brugia malayi Bromodomain containing protein 0.0091 0.0109 0.0113
Trypanosoma cruzi dihydrolipoamide acetyltransferase, putative 0.0153 0.0253 0.0411
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0044 0.0001 0.0003
Brugia malayi Pre-SET motif family protein 0.0251 0.0481 0.0499
Trypanosoma cruzi 2-oxoglutarate dehydrogenase, E2 component, dihydrolipoamide succinyltransferase, putative 0.0153 0.0253 0.0411
Echinococcus multilocularis dihydrolipoyllysine residue acetyltransferase 0.0153 0.0253 0.0253
Brugia malayi Carboxyl transferase domain containing protein 0.421 0.9646 1
Schistosoma mansoni bromodomain containing protein 0.0076 0.0076 0.0076
Mycobacterium ulcerans pyruvate carboxylase 0.1662 0.3747 1
Trypanosoma cruzi 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0591 0.1268 0.2061
Plasmodium vivax biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.3158 0.7209 1
Toxoplasma gondii acetyl-CoA carboxylase ACC1 0.4363 1 1
Schistosoma mansoni propionyl-CoA carboxylase beta chain mitochondrial precursor 0.0591 0.1268 0.1268
Loa Loa (eye worm) hypothetical protein 0.0153 0.0253 0.0262
Leishmania major dihydrolipoamide acetyltransferase precursor, putative 0.0153 0.0253 0.0253
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.0481 0.0498
Schistosoma mansoni alpha-glucosidase 0.0169 0.0292 0.0291
Mycobacterium leprae Probable propionyl-CoA carboxylase beta chain 5 AccD5 (PCCASE) (PROPANOYL-COA:CARBON DIOXIDE LIGASE) 0.0591 0.1268 0.2905
Plasmodium falciparum carbamoyl phosphate synthetase 0.0376 0.0769 0.0742
Trypanosoma brucei pyruvate dehydrogenase complex E3 binding protein, putative 0.0153 0.0253 0.0253
Mycobacterium leprae ACETYL/PROPIONYL-CoA CARBOXYLASE (BETA SUBUNIT) ACCD6 0.0591 0.1268 0.2905
Schistosoma mansoni carbamoyl-phosphate synthetase 0.0376 0.0769 0.0769

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 2.9093 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 3.5481 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) = 11.2202 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Activators of Human alpha-Glucosidase Cleavage of Glycogen. (Class of assay: confirmatory) [Related pubchem assays: 1473, 1466 ] ChEMBL. No reference
Potency (functional) 12.5893 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (binding) = 19.9526 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 20.5962 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 20.5962 uM PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 22.3872 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 22.3872 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Vif-A3F Interactions: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] ChEMBL. No reference
Potency (functional) 29.0929 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 31.6228 uM PubChem BioAssay. qHTS for Inhibitors of Vif-A3G Interactions: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of the ERK Signaling Pathway using a Homogeneous Screening Assay; Stimulation with EGF. (Class of assay: confirmatory) [Related pubchem assays: 995 ] ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS for Inhibitors of Glutaminase (GLS). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] 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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