BDBM50281674 (S)-N-(1-Benzyl-2-phenyl-ethyl)-3-{(S)-2-[(S)-2-(2-{(S)-2-[(S)-2-tert-butoxycarbonylamino-3-(4-sulfooxy-phenyl)-propionylamino]-hexanoylamino}-acetylamino)-3-(1H-indol-3-yl)-propionylamino]-hexanoylamino}-succinamic acid::CHEMBL436690
SMILES: CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(O)=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1
InChI Key: InChIKey=YTBOSCPDDVWIOE-SAVBYNOOSA-N
Data: 2 IC50
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)) | BDBM50281674 ((S)-N-(1-Benzyl-2-phenyl-ethyl)-3-{(S)-2-[(S)-2-(2...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | Article | n/a | n/a | 72 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description In vitro binding affinity against Cholecystokinin type B receptor in guinea pig brain membranes | Bioorg Med Chem Lett 3: 851-854 (1993) Article DOI: 10.1016/S0960-894X(00)80679-4 BindingDB Entry DOI: 10.7270/Q2J9669G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
CCKBR (RAT) | BDBM50281674 ((S)-N-(1-Benzyl-2-phenyl-ethyl)-3-{(S)-2-[(S)-2-(2...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | Article | n/a | n/a | 6.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description In vitro binding affinity against Cholecystokinin type B receptor of rat pancreatic acini | Bioorg Med Chem Lett 3: 851-854 (1993) Article DOI: 10.1016/S0960-894X(00)80679-4 BindingDB Entry DOI: 10.7270/Q2J9669G | |||||||||||
More data for this Ligand-Target Pair |