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Name | Cholecystokinin receptor type A |
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Species | Mus musculus (Mouse) |
Gene | Cckar |
Synonym | CCK-A receptor CCK-AR CCK1 receptor CCK1-R cholecystokinin receptor type A [ Show all ] |
Disease | N/A for non-human GPCRs |
Length | 436 |
Amino acid sequence | MDVVDSLLMNGSNITPPCELGLENETLFCLDQPQPSKEWQSAVQILLYSFIFLLSVLGNTLVITVLIRNKRMRTVTNIFLLSLAVSDLMLCLFCMPFNLIPNLLKDFIFGSAVCKTTTYFMGTSVSVSTFNLVAISLERYGAICRPLQSRVWQTKSHALKVIAATWCLSFTIMTPYPIYSNLVPFTKNNNQTANMCRFLLPSDAMQQSWQTFLLLILFLIPGVVMVVAYGLISLELYQGIKFDASQKKSAKEKRLSSGGGGGGGSSSSRYEDSDGCYLQKSRPPRKLELQQLSTSSSGGRINRIRSSGSAANLIAKKRVIRMLIVIVVLFFLCWMPIFSANAWRAYDTVSAEKHLSGTPISFILLLSYTSSCVNPIIYCFMNKRFRLGFMATFPCCPNPGPTGVRGEVGEEEDGRTIRASLSRYSYSHMSTSAPPH |
UniProt | O08786 |
Protein Data Bank | N/A |
GPCR-HGmod model | N/A |
3D structure model | No available structures or models |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL2798 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL285586 |
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Molecular formula | C36H40N10O5S2 |
IUPAC name | N-[2-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-3-[[2-[3-[1-methyl-3-[(3-methylphenyl)carbamoylamino]-2-oxo-3H-1,4-benzodiazepin-5-yl]phenoxy]acetyl]amino]propanamide |
Molecular weight | 756.901 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 6 |
XlogP | 2.4 |
Synonyms | BDBM50287245 N-[2-(2-Guanidino-thiazol-4-ylmethylsulfanyl)-ethyl]-3-(2-{3-[1-methyl-2-oxo-3-(3-m-tolyl-ureido)-2,3-dihydro-1H-benzo[e][1,4]diazepin-5-yl]-phenoxy}-acetylamino)-propionamide |
Inchi Key | ZDIJKBDHDJOKNO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C36H40N10O5S2/c1-22-7-5-9-24(17-22)41-35(50)44-32-33(49)46(2)28-12-4-3-11-27(28)31(43-32)23-8-6-10-26(18-23)51-19-30(48)39-14-13-29(47)40-15-16-52-20-25-21-53-36(42-25)45-34(37)38/h3-12,17-18,21,32H,13-16,19-20H2,1-2H3,(H,39,48)(H,40,47)(H2,41,44,50)(H4,37,38,42,45) |
PubChem CID | 44280215 |
ChEMBL | CHEMBL285586 |
IUPHAR | N/A |
BindingDB | 50287245 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 2000.0 nM | , Bioorg. Med. Chem. Lett., (1996) 6:13:1421 | BindingDB,ChEMBL |
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