BDBM50083940 4-(3-Chloro-phenyl)-2-hydroxy-4-oxo-but-2-enoic acid (0.2H2O)::CHEMBL184215::CHEMBL278763::Sacchettini_6
SMILES: OC(=O)C(=O)CC(=O)c1cccc(Cl)c1
InChI Key: InChIKey=OGKORXSMGAWLDU-UHFFFAOYSA-N
Data: 4 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
GlcB (Homo sapiens (Human)) | BDBM50083940 (4-(3-Chloro-phenyl)-2-hydroxy-4-oxo-but-2-enoic ac...) | PDB GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | D3R | n/a | n/a | 170 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R | Assay Description DNTB-Coupled_Enzyme_Assay | D3R 223: (2015) BindingDB Entry DOI: 10.7270/Q2NC602G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
DNA excision repair protein ERCC-5 (Homo sapiens (Human)) | BDBM50083940 (4-(3-Chloro-phenyl)-2-hydroxy-4-oxo-but-2-enoic ac...) | PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.31E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Athersys, Inc. Curated by ChEMBL | Assay Description Concentration required for 50% inhibition of Xeroderma pigmentosum G | Bioorg Med Chem Lett 14: 4915-8 (2004) Article DOI: 10.1016/j.bmcl.2004.07.028 BindingDB Entry DOI: 10.7270/Q2ZC82BF | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Flap endonuclease 1 (Homo sapiens (Human)) | BDBM50083940 (4-(3-Chloro-phenyl)-2-hydroxy-4-oxo-but-2-enoic ac...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.96E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Athersys, Inc. Curated by ChEMBL | Assay Description Concentration required for 50% inhibition of Flap endonuclease-1 | Bioorg Med Chem Lett 14: 4915-8 (2004) Article DOI: 10.1016/j.bmcl.2004.07.028 BindingDB Entry DOI: 10.7270/Q2ZC82BF | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Kynurenine 3-monooxygenase (Rattus norvegicus) | BDBM50083940 (4-(3-Chloro-phenyl)-2-hydroxy-4-oxo-but-2-enoic ac...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 320 | n/a | n/a | n/a | n/a | n/a | n/a |
Glaxo Wellcome Research and Development Curated by ChEMBL | Assay Description Inhibition of Kynurenine-3-hydroxylase enzyme isolated from the rat liver | J Med Chem 43: 123-7 (2000) BindingDB Entry DOI: 10.7270/Q2RX9B9B | |||||||||||
More data for this Ligand-Target Pair |