BDBM50008183 4-(8-Aza-spiro[4.5]dec-8-ylcarbamoyl)-4-(3-methoxy-benzoylamino)-butyric acid::CHEMBL125770

SMILES: COc1cccc(c1)C(=O)NC(CCC(O)=O)C(=O)NN1CCC2(CCCC2)CC1

InChI Key: InChIKey=RGANIPXSJARHRV-UHFFFAOYSA-N

Data: 2 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 = 50008183   

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
Cholecystokinin receptor (RAT)	BDBM50008183 (4-(8-Aza-spiro[4.5]dec-8-ylcarbamoyl)-4-(3-methoxy...) Show SMILES COc1cccc(c1)C(=O)NC(CCC(O)=O)C(=O)NN1CCC2(CCCC2)CC1 Show InChI InChI=1S/C22H31N3O5/c1-30-17-6-4-5-16(15-17)20(28)23-18(7-8-19(26)27)21(29)24-25-13-11-22(12-14-25)9-2-3-10-22/h4-6,15,18H,2-3,7-14H2,1H3,(H,23,28)(H,24,29)(H,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Rotta Research Laboratorium Curated by ChEMBL					Assay Description Inhibition of [125I](BH)-CCK-8 binding to cholecystokinin type A receptor in rat pancreatic acini; Inactive				J Med Chem 35: 28-38 (1992) BindingDB Entry DOI: 10.7270/Q2XS5W11
					More data for this Ligand-Target Pair
CCKBR (RAT)	BDBM50008183 (4-(8-Aza-spiro[4.5]dec-8-ylcarbamoyl)-4-(3-methoxy...) Show SMILES COc1cccc(c1)C(=O)NC(CCC(O)=O)C(=O)NN1CCC2(CCCC2)CC1 Show InChI InChI=1S/C22H31N3O5/c1-30-17-6-4-5-16(15-17)20(28)23-18(7-8-19(26)27)21(29)24-25-13-11-22(12-14-25)9-2-3-10-22/h4-6,15,18H,2-3,7-14H2,1H3,(H,23,28)(H,24,29)(H,26,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.65E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rotta Research Laboratorium Curated by ChEMBL					Assay Description Inhibition of the specific binding of [125I](BH)-CCK-8 to Cholecystokinin type B receptor in rat brain cortex				J Med Chem 35: 28-38 (1992) BindingDB Entry DOI: 10.7270/Q2XS5W11
					More data for this Ligand-Target Pair