BDBM50324678 CHEMBL1222314::thiophene-2-carboxylic acid
SMILES: OC(=O)c1cccs1
InChI Key: InChIKey=QERYCTSHXKAMIS-UHFFFAOYSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Beta-lactamase AmpC (Escherichia coli) | BDBM50324678 (CHEMBL1222314 | thiophene-2-carboxylic acid) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents | MMDB PDB Article PubMed | 4.00E+7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of Escherichia coli AmpC assessed as nitrocefin hydrolysis by UV-Vis spectrophotometry | Nat Chem Biol 2: 720-3 (2006) Article DOI: 10.1038/nchembio831 BindingDB Entry DOI: 10.7270/Q2FN16DF | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
D-amino-acid oxidase (Homo sapiens (Human)) | BDBM50324678 (CHEMBL1222314 | thiophene-2-carboxylic acid) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents | Article PubMed | n/a | n/a | 7.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tokushima University Curated by ChEMBL | Assay Description Inhibition of human DAO using D-serine as substrate after 20 mins in presence of FAD | Eur J Med Chem 159: 23-34 (2018) Article DOI: 10.1016/j.ejmech.2018.09.040 BindingDB Entry DOI: 10.7270/Q28918KH | |||||||||||
More data for this Ligand-Target Pair |