BDBM50429333 CHEMBL2334931

SMILES: CC(=O)NS(=O)(=O)c1ccc(\C=C(\C(O)=O)c2ccccc2)cc1

InChI Key: InChIKey=PBRGWBSOMPRTNP-LFIBNONCSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50429333   

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
Aldo-keto reductase family 1 member C1 (Homo sapiens (Human))	BDBM50429333 (CHEMBL2334931) Show SMILES CC(=O)NS(=O)(=O)c1ccc(\C=C(\C(O)=O)c2ccccc2)cc1 Show InChI InChI=1S/C17H15NO5S/c1-12(19)18-24(22,23)15-9-7-13(8-10-15)11-16(17(20)21)14-5-3-2-4-6-14/h2-11H,1H3,(H,18,19)(H,20,21)/b16-11+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of human recombinant AKR1C1 expressed in Escherichia coli assessed as decrease in oxidation of 1-acenaphthenol substrate by spectrophotome...				Eur J Med Chem 62: 89-97 (2013) Article DOI: 10.1016/j.ejmech.2012.12.045 BindingDB Entry DOI: 10.7270/Q2BR8TH0
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member C2 (Homo sapiens (Human))	BDBM50429333 (CHEMBL2334931) Show SMILES CC(=O)NS(=O)(=O)c1ccc(\C=C(\C(O)=O)c2ccccc2)cc1 Show InChI InChI=1S/C17H15NO5S/c1-12(19)18-24(22,23)15-9-7-13(8-10-15)11-16(17(20)21)14-5-3-2-4-6-14/h2-11H,1H3,(H,18,19)(H,20,21)/b16-11+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of recombinant AKR1C2 (unknown origin) assessed as decrease in oxidation of 1-acenaphthenol substrate by spectrophotometric analysis				Eur J Med Chem 62: 89-97 (2013) Article DOI: 10.1016/j.ejmech.2012.12.045 BindingDB Entry DOI: 10.7270/Q2BR8TH0
					More data for this Ligand-Target Pair