Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Proteinase-activated receptor 1' and Ligand = 'BDBM50380022'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Proteinase-activated receptor 1 (Homo sapiens (Human))	BDBM50380022 (CHEMBL2012509) Show SMILES CC[C@@H]1[C@@H](C)C[C@]2(O)[C@@H]([C@@H](C)OC2=O)[C@H]1\C=C\c1ccc(cn1)-c1ccsc1 |r| Show InChI InChI=1S/C23H27NO3S/c1-4-19-14(2)11-23(26)21(15(3)27-22(23)25)20(19)8-7-18-6-5-16(12-24-18)17-9-10-28-13-17/h5-10,12-15,19-21,26H,4,11H2,1-3H3/b8-7+/t14-,15+,19+,20-,21-,23-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.60	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]haTRAP from human PAR1 after 1 hr by TopCount scintillation counting				Bioorg Med Chem Lett 22: 2544-9 (2012) Article DOI: 10.1016/j.bmcl.2012.01.138 BindingDB Entry DOI: 10.7270/Q20G3M58
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