BDBM50317904 3-(4-[(3,5-Dimethylphenyl)amino]-2-{[(1R)-1-(3,5-dimethylphenyl)-3-methylbutyl]carbamoyl}phenyl)propanoic acid::CHEMBL1099047

SMILES: CC(C)C[C@@H](NC(=O)c1cc(Nc2cc(C)cc(C)c2)ccc1CCC(O)=O)c1cc(C)cc(C)c1

InChI Key: InChIKey=VPHANUYHALYOJJ-GDLZYMKVSA-N

Data: 4 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 5 hits for monomerid = 50317904   

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))	BDBM50317904 (3-(4-[(3,5-Dimethylphenyl)amino]-2-{[(1R)-1-(3,5-d...) Show SMILES CC(C)C[C@@H](NC(=O)c1cc(Nc2cc(C)cc(C)c2)ccc1CCC(O)=O)c1cc(C)cc(C)c1 |r| Show InChI InChI=1S/C31H38N2O3/c1-19(2)11-29(25-14-20(3)12-21(4)15-25)33-31(36)28-18-26(9-7-24(28)8-10-30(34)35)32-27-16-22(5)13-23(6)17-27/h7,9,12-19,29,32H,8,10-11H2,1-6H3,(H,33,36)(H,34,35)/t29-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.230	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 EP3alpha receptor expressed in CHO cells after 60 mins by liquid scintillation counting				Bioorg Med Chem 18: 3212-23 (2010) Article DOI: 10.1016/j.bmc.2010.03.028 BindingDB Entry DOI: 10.7270/Q2SF2WB7
					More data for this Ligand-Target Pair
Prostanoid EP4 Receptor (Mus musculus (Mouse))	BDBM50317904 (3-(4-[(3,5-Dimethylphenyl)amino]-2-{[(1R)-1-(3,5-d...) Show SMILES CC(C)C[C@@H](NC(=O)c1cc(Nc2cc(C)cc(C)c2)ccc1CCC(O)=O)c1cc(C)cc(C)c1 |r| Show InChI InChI=1S/C31H38N2O3/c1-19(2)11-29(25-14-20(3)12-21(4)15-25)33-31(36)28-18-26(9-7-24(28)8-10-30(34)35)32-27-16-22(5)13-23(6)17-27/h7,9,12-19,29,32H,8,10-11H2,1-6H3,(H,33,36)(H,34,35)/t29-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	300	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 EP4 receptor expressed in CHO cells after 60 mins by liquid scintillation counting				Bioorg Med Chem 18: 3212-23 (2010) Article DOI: 10.1016/j.bmc.2010.03.028 BindingDB Entry DOI: 10.7270/Q2SF2WB7
					More data for this Ligand-Target Pair
Prostanoid EP2 Receptor (Mus musculus (Mouse))	BDBM50317904 (3-(4-[(3,5-Dimethylphenyl)amino]-2-{[(1R)-1-(3,5-d...) Show SMILES CC(C)C[C@@H](NC(=O)c1cc(Nc2cc(C)cc(C)c2)ccc1CCC(O)=O)c1cc(C)cc(C)c1 |r| Show InChI InChI=1S/C31H38N2O3/c1-19(2)11-29(25-14-20(3)12-21(4)15-25)33-31(36)28-18-26(9-7-24(28)8-10-30(34)35)32-27-16-22(5)13-23(6)17-27/h7,9,12-19,29,32H,8,10-11H2,1-6H3,(H,33,36)(H,34,35)/t29-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.00E+3	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 EP2 receptor expressed in CHO cells after 60 mins by liquid scintillation counting				Bioorg Med Chem 18: 3212-23 (2010) Article DOI: 10.1016/j.bmc.2010.03.028 BindingDB Entry DOI: 10.7270/Q2SF2WB7
					More data for this Ligand-Target Pair
Prostanoid EP1 Receptor (Mus musculus (Mouse))	BDBM50317904 (3-(4-[(3,5-Dimethylphenyl)amino]-2-{[(1R)-1-(3,5-d...) Show SMILES CC(C)C[C@@H](NC(=O)c1cc(Nc2cc(C)cc(C)c2)ccc1CCC(O)=O)c1cc(C)cc(C)c1 |r| Show InChI InChI=1S/C31H38N2O3/c1-19(2)11-29(25-14-20(3)12-21(4)15-25)33-31(36)28-18-26(9-7-24(28)8-10-30(34)35)32-27-16-22(5)13-23(6)17-27/h7,9,12-19,29,32H,8,10-11H2,1-6H3,(H,33,36)(H,34,35)/t29-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	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 EP1 receptor expressed in CHO cells after 20 mins by liquid scintillation counting				Bioorg Med Chem 18: 3212-23 (2010) Article DOI: 10.1016/j.bmc.2010.03.028 BindingDB Entry DOI: 10.7270/Q2SF2WB7
					More data for this Ligand-Target Pair
Prostanoid EP3 Receptor (Mus musculus (Mouse))	BDBM50317904 (3-(4-[(3,5-Dimethylphenyl)amino]-2-{[(1R)-1-(3,5-d...) Show SMILES CC(C)C[C@@H](NC(=O)c1cc(Nc2cc(C)cc(C)c2)ccc1CCC(O)=O)c1cc(C)cc(C)c1 |r| Show InChI InChI=1S/C31H38N2O3/c1-19(2)11-29(25-14-20(3)12-21(4)15-25)33-31(36)28-18-26(9-7-24(28)8-10-30(34)35)32-27-16-22(5)13-23(6)17-27/h7,9,12-19,29,32H,8,10-11H2,1-6H3,(H,33,36)(H,34,35)/t29-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem 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: 3212-23 (2010) Article DOI: 10.1016/j.bmc.2010.03.028 BindingDB Entry DOI: 10.7270/Q2SF2WB7
					More data for this Ligand-Target Pair