BDBM50307448 3-[4-[(3-Cyanophenoxy)methyl]-2-({[1-(3,4-dimethoxyphenyl)-3-methylbutyl]amino}carbonyl)phenyl]propanoic acid::CHEMBL597367

SMILES COc1ccc(cc1OC)C(CC(C)C)NC(=O)c1cc(COc2cccc(c2)C#N)ccc1CCC(O)=O

InChI Key InChIKey=HKMMZKDOAJRAAE-UHFFFAOYSA-N

Data  1 KI  1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50307448   

TargetProstaglandin E2 receptor EP3 subtype(Mus musculus (Mouse))
Minase Research Institute

Curated by ChEMBL
LigandPNGBDBM50307448(3-[4-[(3-Cyanophenoxy)methyl]-2-({[1-(3,4-dimethox...)
Show SMILES COc1ccc(cc1OC)C(CC(C)C)NC(=O)c1cc(COc2cccc(c2)C#N)ccc1CCC(O)=O
Show InChI InChI=1S/C31H34N2O6/c1-20(2)14-27(24-10-12-28(37-3)29(17-24)38-4)33-31(36)26-16-22(8-9-23(26)11-13-30(34)35)19-39-25-7-5-6-21(15-25)18-32/h5-10,12,15-17,20,27H,11,13-14,19H2,1-4H3,(H,33,36)(H,34,35)
Affinity DataKi:  0.670nMAssay Description:Displacement of [3H]PGE2 from mouse EP3 receptor expressed in CHO cell membraneMore data for this Ligand-Target Pair
TargetProstaglandin E2 receptor EP3 subtype(Mus musculus (Mouse))
Minase Research Institute

Curated by ChEMBL
LigandPNGBDBM50307448(3-[4-[(3-Cyanophenoxy)methyl]-2-({[1-(3,4-dimethox...)
Show SMILES COc1ccc(cc1OC)C(CC(C)C)NC(=O)c1cc(COc2cccc(c2)C#N)ccc1CCC(O)=O
Show InChI InChI=1S/C31H34N2O6/c1-20(2)14-27(24-10-12-28(37-3)29(17-24)38-4)33-31(36)26-16-22(8-9-23(26)11-13-30(34)35)19-39-25-7-5-6-21(15-25)18-32/h5-10,12,15-17,20,27H,11,13-14,19H2,1-4H3,(H,33,36)(H,34,35)
Affinity DataIC50: 3.70nMAssay Description:Antagonist activity at mouse EP3 receptor expressed in CHO cells assessed as inhibition of PGE2-induced increase intracellular calcium level in prese...More data for this Ligand-Target Pair