Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Proteinase-activated receptor 1' and Ligand = 'BDBM50179569'   

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))	BDBM50179569 ((+/-)-(3R,3aS,4S,4aR,8aS,9aR)-4-(2-(6-methoxyquino...) Show SMILES COc1ccc2nc(\C=C\[C@@H]3[C@@H]4[C@@H](C)OC(=O)[C@@H]4C[C@@H]4CCCC[C@@H]34)ccc2c1 Show InChI InChI=1S/C25H29NO3/c1-15-24-21(20-6-4-3-5-16(20)14-22(24)25(27)29-15)11-9-18-8-7-17-13-19(28-2)10-12-23(17)26-18/h7-13,15-16,20-22,24H,3-6,14H2,1-2H3/b11-9+/t15-,16+,20-,21+,22-,24+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]haTRAP from PAR1 in human platelet membrane				Bioorg Med Chem Lett 16: 1544-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.042 BindingDB Entry DOI: 10.7270/Q2KH0MXM
					More data for this Ligand-Target Pair
Proteinase-activated receptor 1 (Homo sapiens (Human))	BDBM50179569 ((+/-)-(3R,3aS,4S,4aR,8aS,9aR)-4-(2-(6-methoxyquino...) Show SMILES COc1ccc2nc(\C=C\[C@@H]3[C@@H]4[C@@H](C)OC(=O)[C@@H]4C[C@@H]4CCCC[C@@H]34)ccc2c1 Show InChI InChI=1S/C25H29NO3/c1-15-24-21(20-6-4-3-5-16(20)14-22(24)25(27)29-15)11-9-18-8-7-17-13-19(28-2)10-12-23(17)26-18/h7-13,15-16,20-22,24H,3-6,14H2,1-2H3/b11-9+/t15-,16+,20-,21+,22-,24+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Binding affinity to PAR1 in human platelet membrane				Bioorg Med Chem Lett 16: 4969-72 (2006) Article DOI: 10.1016/j.bmcl.2006.06.042 BindingDB Entry DOI: 10.7270/Q2CV4HC9
					More data for this Ligand-Target Pair
Proteinase-activated receptor 1 (Homo sapiens (Human))	BDBM50179569 ((+/-)-(3R,3aS,4S,4aR,8aS,9aR)-4-(2-(6-methoxyquino...) Show SMILES COc1ccc2nc(\C=C\[C@@H]3[C@@H]4[C@@H](C)OC(=O)[C@@H]4C[C@@H]4CCCC[C@@H]34)ccc2c1 Show InChI InChI=1S/C25H29NO3/c1-15-24-21(20-6-4-3-5-16(20)14-22(24)25(27)29-15)11-9-18-8-7-17-13-19(28-2)10-12-23(17)26-18/h7-13,15-16,20-22,24H,3-6,14H2,1-2H3/b11-9+/t15-,16+,20-,21+,22-,24+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]haTRAP from PAR1 in human platelet membrane				Bioorg Med Chem Lett 16: 1544-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.042 BindingDB Entry DOI: 10.7270/Q2KH0MXM
					More data for this Ligand-Target Pair