BDBM50281668 Boc-Trp-Phe-Asp-1Nal-NH2::CHEMBL171594

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

InChI Key: InChIKey=FPVZBTVLTPLRDX-BBACVFHCSA-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 = 50281668   

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))	BDBM50281668 (Boc-Trp-Phe-Asp-1Nal-NH2 | CHEMBL171594) Show SMILES CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O Show InChI InChI=1S/C42H46N6O8/c1-42(2,3)56-41(55)48-34(22-28-24-44-31-19-10-9-18-30(28)31)39(53)46-33(20-25-12-5-4-6-13-25)38(52)47-35(23-36(49)50)40(54)45-32(37(43)51)21-27-16-11-15-26-14-7-8-17-29(26)27/h4-19,24,32-35,44H,20-23H2,1-3H3,(H2,43,51)(H,45,54)(H,46,53)(H,47,52)(H,48,55)(H,49,50)/t32-,33-,34-,35-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	71	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for the inhibition of [3H]-pCCK-8 to Cholecystokinin type B receptor in guinea pig brain				Bioorg Med Chem Lett 3: 847-850 (1993) Article DOI: 10.1016/S0960-894X(00)80678-2 BindingDB Entry DOI: 10.7270/Q2P26Z28
					More data for this Ligand-Target Pair
Cholecystokinin A receptor (Cavia porcellus)	BDBM50281668 (Boc-Trp-Phe-Asp-1Nal-NH2 | CHEMBL171594) Show SMILES CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O Show InChI InChI=1S/C42H46N6O8/c1-42(2,3)56-41(55)48-34(22-28-24-44-31-19-10-9-18-30(28)31)39(53)46-33(20-25-12-5-4-6-13-25)38(52)47-35(23-36(49)50)40(54)45-32(37(43)51)21-27-16-11-15-26-14-7-8-17-29(26)27/h4-19,24,32-35,44H,20-23H2,1-3H3,(H2,43,51)(H,45,54)(H,46,53)(H,47,52)(H,48,55)(H,49,50)/t32-,33-,34-,35-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for the inhibition of [3H]-pCCK-8 binding to Cholecystokinin type A receptor in pancreatic membranes of guinea-pig				Bioorg Med Chem Lett 3: 847-850 (1993) Article DOI: 10.1016/S0960-894X(00)80678-2 BindingDB Entry DOI: 10.7270/Q2P26Z28
					More data for this Ligand-Target Pair