BDBM50018183 2-Imidazol-1-ylmethyl-4,5,6,7-tetrahydro-benzo[b]thiophene-5-carboxylic acid::CHEMBL281646

SMILES: OC(=O)C1CCc2sc(Cn3ccnc3)cc2C1

InChI Key: InChIKey=JKYIFGRLLASWQN-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50018183   

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
Thromboxane A2 Synthase (P450 TxA2) (Homo sapiens (Human))	BDBM50018183 (2-Imidazol-1-ylmethyl-4,5,6,7-tetrahydro-benzo[b]t...) Show SMILES OC(=O)C1CCc2sc(Cn3ccnc3)cc2C1 Show InChI InChI=1S/C13H14N2O2S/c16-13(17)9-1-2-12-10(5-9)6-11(18-12)7-15-4-3-14-8-15/h3-4,6,8-9H,1-2,5,7H2,(H,16,17)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	86	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of thromboxane A2 synthetase				J Med Chem 32: 1265-72 (1989) BindingDB Entry DOI: 10.7270/Q2FF3RBV
					More data for this Ligand-Target Pair