BDBM50107281 CHEMBL3600787

SMILES: Cl.CC[C@H](NC(=O)[C@H]1CCCCN1CCOc1ccccc1)c1ccc(cc1)C(O)=O

InChI Key: InChIKey=ZOVZMQGNDCGVEF-FCHUYYIVSA-N

Data: 1 KI  3 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 4 hits for monomerid = 50107281   

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))	BDBM50107281 (CHEMBL3600787) Show SMILES Cl.CC[C@H](NC(=O)[C@H]1CCCCN1CCOc1ccccc1)c1ccc(cc1)C(O)=O |r| Show InChI InChI=1S/C24H30N2O4/c1-2-21(18-11-13-19(14-12-18)24(28)29)25-23(27)22-10-6-7-15-26(22)16-17-30-20-8-4-3-5-9-20/h3-5,8-9,11-14,21-22H,2,6-7,10,15-17H2,1H3,(H,25,27)(H,28,29)/t21-,22+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	129	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]-PGE2 from recombinant human EP4 receptor expressed in HEK293 cell membranes after 90 mins by liquid scintillation counting analy...				Bioorg Med Chem Lett 25: 3176-8 (2015) BindingDB Entry DOI: 10.7270/Q2FX7C79
					More data for this Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype (Homo sapiens (Human))	BDBM50107281 (CHEMBL3600787) Show SMILES Cl.CC[C@H](NC(=O)[C@H]1CCCCN1CCOc1ccccc1)c1ccc(cc1)C(O)=O |r| Show InChI InChI=1S/C24H30N2O4/c1-2-21(18-11-13-19(14-12-18)24(28)29)25-23(27)22-10-6-7-15-26(22)16-17-30-20-8-4-3-5-9-20/h3-5,8-9,11-14,21-22H,2,6-7,10,15-17H2,1H3,(H,25,27)(H,28,29)/t21-,22+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	232	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]-PGE2 from recombinant human EP4 receptor expressed in HEK293 cell membranes after 90 mins by liquid scintillation counting analy...				Bioorg Med Chem Lett 25: 3176-8 (2015) BindingDB Entry DOI: 10.7270/Q2FX7C79
					More data for this Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype (Homo sapiens (Human))	BDBM50107281 (CHEMBL3600787) Show SMILES Cl.CC[C@H](NC(=O)[C@H]1CCCCN1CCOc1ccccc1)c1ccc(cc1)C(O)=O |r| Show InChI InChI=1S/C24H30N2O4/c1-2-21(18-11-13-19(14-12-18)24(28)29)25-23(27)22-10-6-7-15-26(22)16-17-30-20-8-4-3-5-9-20/h3-5,8-9,11-14,21-22H,2,6-7,10,15-17H2,1H3,(H,25,27)(H,28,29)/t21-,22+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	291	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Antagonist activity at EP4 receptor in LPS-stimulated human whole blood assessed as inhibition of PGE2-induced TNF-alpha reduction preincubated for 3...				Bioorg Med Chem Lett 25: 3176-8 (2015) BindingDB Entry DOI: 10.7270/Q2FX7C79
					More data for this Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype (Homo sapiens (Human))	BDBM50107281 (CHEMBL3600787) Show SMILES Cl.CC[C@H](NC(=O)[C@H]1CCCCN1CCOc1ccccc1)c1ccc(cc1)C(O)=O |r| Show InChI InChI=1S/C24H30N2O4/c1-2-21(18-11-13-19(14-12-18)24(28)29)25-23(27)22-10-6-7-15-26(22)16-17-30-20-8-4-3-5-9-20/h3-5,8-9,11-14,21-22H,2,6-7,10,15-17H2,1H3,(H,25,27)(H,28,29)/t21-,22+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Antagonist activity at recombinant human EP4 receptor expressed in HEK293 cells assessed as inhibition of PGE2-stimulated cAMP accumulation by scinti...				Bioorg Med Chem Lett 25: 3176-8 (2015) BindingDB Entry DOI: 10.7270/Q2FX7C79
					More data for this Ligand-Target Pair