BDBM50008210 4-(8-Aza-spiro[4.5]dec-8-ylcarbamoyl)-4-(3-trifluoromethyl-benzoylamino)-butyric acid::CHEMBL124261

SMILES: OC(=O)CCC(NC(=O)c1cccc(c1)C(F)(F)F)C(=O)NN1CCC2(CCCC2)CC1

InChI Key: InChIKey=DDJMGEREPLKKJS-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 = 50008210   

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
CCKBR (RAT)	BDBM50008210 (4-(8-Aza-spiro[4.5]dec-8-ylcarbamoyl)-4-(3-trifluo...) Show SMILES OC(=O)CCC(NC(=O)c1cccc(c1)C(F)(F)F)C(=O)NN1CCC2(CCCC2)CC1 Show InChI InChI=1S/C22H28F3N3O4/c23-22(24,25)16-5-3-4-15(14-16)19(31)26-17(6-7-18(29)30)20(32)27-28-12-10-21(11-13-28)8-1-2-9-21/h3-5,14,17H,1-2,6-13H2,(H,26,31)(H,27,32)(H,29,30)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.20E+3	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
Cholecystokinin receptor (RAT)	BDBM50008210 (4-(8-Aza-spiro[4.5]dec-8-ylcarbamoyl)-4-(3-trifluo...) Show SMILES OC(=O)CCC(NC(=O)c1cccc(c1)C(F)(F)F)C(=O)NN1CCC2(CCCC2)CC1 Show InChI InChI=1S/C22H28F3N3O4/c23-22(24,25)16-5-3-4-15(14-16)19(31)26-17(6-7-18(29)30)20(32)27-28-12-10-21(11-13-28)8-1-2-9-21/h3-5,14,17H,1-2,6-13H2,(H,26,31)(H,27,32)(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rotta Research Laboratorium Curated by ChEMBL					Assay Description Concentration required to inhibit by 50% specific binding of [125I](BH)-CCK-8 to cholecystokinin type A receptor in rat pancreatic acini				J Med Chem 35: 28-38 (1992) BindingDB Entry DOI: 10.7270/Q2XS5W11
					More data for this Ligand-Target Pair