BDBM50046118 CHEMBL3351057::CHEMBL46843::N-{[1-tert-Butoxycarbonyl-2-(1H-indol-3-yl)-ethylcarbamoyl]-phenyl-methyl}-3-(2-dimethylamino-3-naphthalen-1-yl-propionylamino)-succinamic acid
SMILES: CN(C)[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C)c1ccccc1
InChI Key: InChIKey=HQWFKIKZWCAFFU-OVVPJKSGSA-N
Data: 3 KI
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)) | BDBM50046118 (CHEMBL3351057 | N-{[1-tert-Butoxycarbonyl-2-(1H-in...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 39 | 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 | |||||||||||||
CCKBR (RAT) | BDBM50046118 (CHEMBL3351057 | N-{[1-tert-Butoxycarbonyl-2-(1H-in...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 51 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
INSERM Curated by ChEMBL | Assay Description Affinity of compound on binding of [3H]pCCK-8 to the cholecystokinin type B receptor in rat 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) | BDBM50046118 (CHEMBL3351057 | N-{[1-tert-Butoxycarbonyl-2-(1H-in...) | PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1.00E+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 |