BDBM50144114 1-(2-{4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-1-[4-(1-methyl-4,5-dihydro-1H-imidazol-2-yl)-benzoyl]-piperazin-2-yl}-acetyl)-piperidine-4-carboxylic acid methyl ester::CHEMBL64994

SMILES: COC(=O)C1CCN(CC1)C(=O)CC1CN(CCN1C(=O)c1ccc(cc1)C1=NCCN1C)S(=O)(=O)c1cc2ccc(Cl)cc2s1

InChI Key: InChIKey=SEAINQSKDZVMFT-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 = 50144114   

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
Coagulation factor X (Homo sapiens (Human))	BDBM50144114 (1-(2-{4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-1-...) Show SMILES COC(=O)C1CCN(CC1)C(=O)CC1CN(CCN1C(=O)c1ccc(cc1)C1=NCCN1C)S(=O)(=O)c1cc2ccc(Cl)cc2s1 |t:30| Show InChI InChI=1S/C32H36ClN5O6S2/c1-35-14-11-34-30(35)21-3-5-22(6-4-21)31(40)38-16-15-37(46(42,43)29-17-24-7-8-25(33)18-27(24)45-29)20-26(38)19-28(39)36-12-9-23(10-13-36)32(41)44-2/h3-8,17-18,23,26H,9-16,19-20H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against Coagulation factor X was determined				Bioorg Med Chem Lett 14: 2073-8 (2004) Article DOI: 10.1016/j.bmcl.2004.02.049 BindingDB Entry DOI: 10.7270/Q2P84B98
					More data for this Ligand-Target Pair