BDBM50307415 3-[2-({[1-(4-Methoxyphenyl)-3-methylbutyl]amino}-carbonyl)-4-(phenoxymethyl)phenyl]propanoic acid::CHEMBL602687

SMILES: COc1ccc(cc1)C(CC(C)C)NC(=O)c1cc(COc2ccccc2)ccc1CCC(O)=O

InChI Key: InChIKey=BMOHLTABKALFMV-UHFFFAOYSA-N

Data: 1 KI  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 2 hits for monomerid = 50307415   

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
Prostanoid EP3 Receptor (Mus musculus (Mouse))	BDBM50307415 (3-[2-({[1-(4-Methoxyphenyl)-3-methylbutyl]amino}-c...) Show SMILES COc1ccc(cc1)C(CC(C)C)NC(=O)c1cc(COc2ccccc2)ccc1CCC(O)=O Show InChI InChI=1S/C29H33NO5/c1-20(2)17-27(23-11-14-24(34-3)15-12-23)30-29(33)26-18-21(9-10-22(26)13-16-28(31)32)19-35-25-7-5-4-6-8-25/h4-12,14-15,18,20,27H,13,16-17,19H2,1-3H3,(H,30,33)(H,31,32)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.360	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]PGE2 from mouse EP3 receptor expressed in CHO cell membrane				Bioorg Med Chem 18: 1641-58 (2010) Article DOI: 10.1016/j.bmc.2009.12.068 BindingDB Entry DOI: 10.7270/Q29023W2
					More data for this Ligand-Target Pair
Prostanoid EP3 Receptor (Mus musculus (Mouse))	BDBM50307415 (3-[2-({[1-(4-Methoxyphenyl)-3-methylbutyl]amino}-c...) Show SMILES COc1ccc(cc1)C(CC(C)C)NC(=O)c1cc(COc2ccccc2)ccc1CCC(O)=O Show InChI InChI=1S/C29H33NO5/c1-20(2)17-27(23-11-14-24(34-3)15-12-23)30-29(33)26-18-21(9-10-22(26)13-16-28(31)32)19-35-25-7-5-4-6-8-25/h4-12,14-15,18,20,27H,13,16-17,19H2,1-3H3,(H,30,33)(H,31,32)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	59	n/a	n/a	n/a	n/a	n/a	n/a
Minase Research Institute Curated by ChEMBL					Assay Description Antagonist activity at mouse EP3 receptor expressed in CHO cells assessed as inhibition of PGE2-induced increase intracellular calcium level in prese...				Bioorg Med Chem 18: 1641-58 (2010) Article DOI: 10.1016/j.bmc.2009.12.068 BindingDB Entry DOI: 10.7270/Q29023W2
					More data for this Ligand-Target Pair