Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Prostaglandin E2 receptor EP3 subtype' and Ligand = 'BDBM50308905'   

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
Prostaglandin E2 receptor EP3 subtype (Mus musculus (Mouse))	BDBM50308905 (3-[2-({[3-Methyl-1-(1-naphthyl)butyl]amino}carbony...) Show SMILES CC(C)CC(NC(=O)c1cc(COc2ccccc2)ccc1CCC(O)=O)c1cccc2ccccc12 Show InChI InChI=1S/C32H33NO4/c1-22(2)19-30(28-14-8-10-24-9-6-7-13-27(24)28)33-32(36)29-20-23(15-16-25(29)17-18-31(34)35)21-37-26-11-4-3-5-12-26/h3-16,20,22,30H,17-19,21H2,1-2H3,(H,33,36)(H,34,35)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.340	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Minase Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]PGE3alpha from mouse EP3alpha receptor expressed in CHO cells by liquid scintillation counting				Bioorg Med Chem 18: 80-90 (2010) Article DOI: 10.1016/j.bmc.2009.11.023 BindingDB Entry DOI: 10.7270/Q24X57X2
					More data for this Ligand-Target Pair
Prostaglandin E2 receptor EP3 subtype (Mus musculus (Mouse))	BDBM50308905 (3-[2-({[3-Methyl-1-(1-naphthyl)butyl]amino}carbony...) Show SMILES CC(C)CC(NC(=O)c1cc(COc2ccccc2)ccc1CCC(O)=O)c1cccc2ccccc12 Show InChI InChI=1S/C32H33NO4/c1-22(2)19-30(28-14-8-10-24-9-6-7-13-27(24)28)33-32(36)29-20-23(15-16-25(29)17-18-31(34)35)21-37-26-11-4-3-5-12-26/h3-16,20,22,30H,17-19,21H2,1-2H3,(H,33,36)(H,34,35)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Minase Research Institute Curated by ChEMBL					Assay Description Antagonist activity at mouse EP3alpha receptor expressed in CHO cells assessed as inhibition of PGE2-induced increase in intracellular calcium level ...				Bioorg Med Chem 18: 80-90 (2010) Article DOI: 10.1016/j.bmc.2009.11.023 BindingDB Entry DOI: 10.7270/Q24X57X2
					More data for this Ligand-Target Pair