BDBM50092394 (S)-3-((S)-2-{[(S)-2-(2-Amino-acetylamino)-3-(S)-1H-indol-3-yl-propionyl]-methyl-amino}-hexanoylamino)-N-(1-carbamoyl-2-phenyl-ethyl)-succinamic acid::3-(2-{[2-(2-Amino-acetylamino)-3-(1H-indol-3-yl)-propionyl]-methyl-amino}-hexanoylamino)-N-(1-carbamoyl-2-phenyl-ethyl)-succinamic acid::CHEMBL59865
SMILES: CCCC[C@H](N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
InChI Key: InChIKey=CXNFPROZKYIEPE-FWEHEUNISA-N
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 A receptor (Cavia porcellus) | BDBM50092394 ((S)-3-((S)-2-{[(S)-2-(2-Amino-acetylamino)-3-(S)-1...) | PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
INSERM Curated by ChEMBL | Assay Description Affinity against Cholecystokinin type A receptor on guinea pig pancreatic membranes. | J Med Chem 43: 3614-23 (2000) BindingDB Entry DOI: 10.7270/Q2RN373C | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cholecystokinin receptor (Homo sapiens (Human)) | BDBM50092394 ((S)-3-((S)-2-{[(S)-2-(2-Amino-acetylamino)-3-(S)-1...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
INSERM Curated by ChEMBL | Assay Description Binding affinity against cholecystokinin type B receptor on guinea pig cortex. | J Med Chem 43: 3614-23 (2000) BindingDB Entry DOI: 10.7270/Q2RN373C | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cholecystokinin receptor (Homo sapiens (Human)) | BDBM50092394 ((S)-3-((S)-2-{[(S)-2-(2-Amino-acetylamino)-3-(S)-1...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article | n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Compound was tested for its binding affinity towards Cholecystokinin type B receptor in cortical membranes (CNS) | Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cholecystokinin receptor (Homo sapiens (Human)) | BDBM50092394 ((S)-3-((S)-2-{[(S)-2-(2-Amino-acetylamino)-3-(S)-1...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Compound was tested for its binding affinity towards Cholecystokinin type A receptor in pancreatic membranes | Bioorg Med Chem Lett 3: 2011-2016 (1993) Article DOI: 10.1016/S0960-894X(01)81005-2 BindingDB Entry DOI: 10.7270/Q2B27V63 | |||||||||||
More data for this Ligand-Target Pair |