BDBM50372059 CHEMBL405446

SMILES: CCOc1c2C(=O)N(Cc2c(OCC)c2ncccc12)c1ccc(CS(=O)(=O)NC(=O)C2(CC2)c2c(OC)cccc2OC)cc1C

InChI Key: InChIKey=VZZHNJDWBJVVKC-UHFFFAOYSA-N

Data: 2 KI

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 = 50372059   

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
Prostaglandin E2 receptor EP4 subtype (Homo sapiens (Human))	BDBM50372059 (CHEMBL405446) Show SMILES CCOc1c2C(=O)N(Cc2c(OCC)c2ncccc12)c1ccc(CS(=O)(=O)NC(=O)C2(CC2)c2c(OC)cccc2OC)cc1C Show InChI InChI=1S/C35H37N3O8S/c1-6-45-31-23-10-9-17-36-30(23)32(46-7-2)24-19-38(33(39)28(24)31)25-14-13-22(18-21(25)3)20-47(41,42)37-34(40)35(15-16-35)29-26(43-4)11-8-12-27(29)44-5/h8-14,17-18H,6-7,15-16,19-20H2,1-5H3,(H,37,40)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.540	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description Binding affinity to human EP4 receptor expressed in HEK293 cells				Bioorg Med Chem Lett 18: 2048-54 (2008) Article DOI: 10.1016/j.bmcl.2008.01.103 BindingDB Entry DOI: 10.7270/Q2J96770
					More data for this Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype (Homo sapiens (Human))	BDBM50372059 (CHEMBL405446) Show SMILES CCOc1c2C(=O)N(Cc2c(OCC)c2ncccc12)c1ccc(CS(=O)(=O)NC(=O)C2(CC2)c2c(OC)cccc2OC)cc1C Show InChI InChI=1S/C35H37N3O8S/c1-6-45-31-23-10-9-17-36-30(23)32(46-7-2)24-19-38(33(39)28(24)31)25-14-13-22(18-21(25)3)20-47(41,42)37-34(40)35(15-16-35)29-26(43-4)11-8-12-27(29)44-5/h8-14,17-18H,6-7,15-16,19-20H2,1-5H3,(H,37,40)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description Binding affinity to human EP4 receptor expressed in HEK293 cells in presence of 10% human serum				Bioorg Med Chem Lett 18: 2048-54 (2008) Article DOI: 10.1016/j.bmcl.2008.01.103 BindingDB Entry DOI: 10.7270/Q2J96770
					More data for this Ligand-Target Pair