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Name | Cholecystokinin receptor type A |
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Species | Homo sapiens (Human) |
Gene | CCKAR |
Synonym | cholecystokinin-1 receptor CCK1-R CCK1 receptor CCK-AR CCK-A receptor [ Show all ] |
Disease | Pancreatic cancer; Obesity Eating disorder Pancreatic disease Gallstone prophylaxis; Obesity Gastrointestinal disease [ Show all ] |
Length | 428 |
Amino acid sequence | MDVVDSLLVNGSNITPPCELGLENETLFCLDQPRPSKEWQPAVQILLYSLIFLLSVLGNTLVITVLIRNKRMRTVTNIFLLSLAVSDLMLCLFCMPFNLIPNLLKDFIFGSAVCKTTTYFMGTSVSVSTFNLVAISLERYGAICKPLQSRVWQTKSHALKVIAATWCLSFTIMTPYPIYSNLVPFTKNNNQTANMCRFLLPNDVMQQSWHTFLLLILFLIPGIVMMVAYGLISLELYQGIKFEASQKKSAKERKPSTTSSGKYEDSDGCYLQKTRPPRKLELRQLSTGSSSRANRIRSNSSAANLMAKKRVIRMLIVIVVLFFLCWMPIFSANAWRAYDTASAERRLSGTPISFILLLSYTSSCVNPIIYCFMNKRFRLGFMATFPCCPNPGPPGARGEVGEEEEGGTTGASLSRFSYSHMSASVPPQ |
UniProt | P32238 |
Protein Data Bank | 1d6g |
GPCR-HGmod model | P32238 |
3D structure model | This structure is from PDB ID 1d6g. |
BioLiP | BL0007611 |
Therapeutic Target Database | T28330 |
ChEMBL | CHEMBL1901 |
IUPHAR | 76 |
DrugBank | BE0000402 |
Name | CHEMBL264150 |
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Molecular formula | C30H37N9O4 |
IUPAC name | 2-[5-cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2,4-dioxo-1,3,5-benzotriazepin-3-yl]-N-[3-[methyl(2H-tetrazol-5-yl)amino]phenyl]acetamide |
Molecular weight | 587.685 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 2 |
XlogP | 4.2 |
Synonyms | 2-[1-Cyclohexyl-5-(3,3-dimethyl-2-oxo-butyl)-2,4-dioxo-1,2,4,5-tetrahydro-1,3,5-benzotriazepin-3-yl]-N-{3-[methyl-(2H-tetrazol-5-yl)-amino]-phenyl}-acetamide SCHEMBL5436447 BDBM50411971 FBOPUWVLYGBEMF-UHFFFAOYSA-N |
Inchi Key | FBOPUWVLYGBEMF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H37N9O4/c1-30(2,3)25(40)18-37-23-15-8-9-16-24(23)39(21-12-6-5-7-13-21)29(43)38(28(37)42)19-26(41)31-20-11-10-14-22(17-20)36(4)27-32-34-35-33-27/h8-11,14-17,21H,5-7,12-13,18-19H2,1-4H3,(H,31,41)(H,32,33,34,35) |
PubChem CID | 44451547 |
ChEMBL | CHEMBL264150 |
IUPHAR | N/A |
BindingDB | 50411971 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 2089.3 nM | PMID18289857 | ChEMBL |
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