BDBM50046129 3-(2-Amino-3-naphthalen-1-yl-propionylamino)-N-(1-{[1-tert-butoxycarbonyl-2-(1H-indol-3-yl)-ethyl]-methyl-carbamoyl}-2-phenyl-ethyl)-succinamic acid::CHEMBL299823::CHEMBL3351061

SMILES: CN([C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](N)Cc1cccc2ccccc12

InChI Key: InChIKey=KGDWORXKGDLQGS-DCZZOZOESA-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 = 50046129   

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 (Homo sapiens (Human))	BDBM50046129 (3-(2-Amino-3-naphthalen-1-yl-propionylamino)-N-(1-...) Show SMILES CN([C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](N)Cc1cccc2ccccc12 Show InChI InChI=1S/C42H47N5O7/c1-42(2,3)54-41(53)36(23-29-25-44-33-20-11-10-19-31(29)33)47(4)40(52)35(21-26-13-6-5-7-14-26)46-39(51)34(24-37(48)49)45-38(50)32(43)22-28-17-12-16-27-15-8-9-18-30(27)28/h5-20,25,32,34-36,44H,21-24,43H2,1-4H3,(H,45,50)(H,46,51)(H,48,49)/t32-,34-,35-,36-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	770	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Displacement of [3H]pCCK-8 from cholecystokinin type B receptor in guinea pig brain membrane				J Med Chem 36: 166-72 (1993) BindingDB Entry DOI: 10.7270/Q26M37FJ
					More data for this Ligand-Target Pair
Cholecystokinin A receptor (Cavia porcellus)	BDBM50046129 (3-(2-Amino-3-naphthalen-1-yl-propionylamino)-N-(1-...) Show SMILES CN([C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](N)Cc1cccc2ccccc12 Show InChI InChI=1S/C42H47N5O7/c1-42(2,3)54-41(53)36(23-29-25-44-33-20-11-10-19-31(29)33)47(4)40(52)35(21-26-13-6-5-7-14-26)46-39(51)34(24-37(48)49)45-38(50)32(43)22-28-17-12-16-27-15-8-9-18-30(27)28/h5-20,25,32,34-36,44H,21-24,43H2,1-4H3,(H,45,50)(H,46,51)(H,48,49)/t32-,34-,35-,36-/m1/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Displacement of [3H]-pCCK-8 from cholecystokinin-A receptor in guinea pig pancreatic membrane				J Med Chem 36: 166-72 (1993) BindingDB Entry DOI: 10.7270/Q26M37FJ
					More data for this Ligand-Target Pair