Reaction Details Report a problem with these data
Target
Gastrin/cholecystokinin type B receptor
Ligand
BDBM50230671
Substrate
n/a
Meas. Tech.
ChEMBL_48424 (CHEMBL660352)
Ki
46±n/a nM
Citation
 Higginbottom, M; Kneen, C; Ratcliffe, GS Rationally designed"dipeptoid" analogues of CCK. A Free-Wilson/Fujita-Ban analysis of some alpha-methyltryptophan derivatives as CCK-B antagonists. J Med Chem 35:1572-7 (1992) [PubMed]  Article 
Target
Name:
Gastrin/cholecystokinin type B receptor
Synonyms:
Cckbr | Cholecystokinin A | Cholecystokinin receptor | GASR_MOUSE | Gastrin/cholecystokinin type B receptor
Type:
Enzyme Catalytic Domain
Mol. Mass.:
49196.59
Organism:
MOUSE
Description:
Cholecystokinin A CCKBR MOUSE::P56481
Residue:
453
Sequence:
MDLLKLNRSLQGPGPGSGSSLCRPGVSLLNSSSAGNLSCETPRIRGTGTRELELTIRITLYAVIFLMSVGGNVLIIVVLGLSRRLRTVTNAFLLSLAVSDLLLAVACMPFTLLPNLMGTFIFGTVICKAVSYLMGVSVSVSTLNLAAIALERYSAICRPLQARVWQTRSHAARVILATWLLSGLLMVPYPVYTVVQPVGPRILQCMHLWPSERVQQMWSVLLLILLFFIPGVVMAVAYGLISRELYLGLRFDGDNDSETQSRVRNQGGLPGGAAAPGPVHQNGGCRHVTSLTGEDSDGCYVQLPRSRLEMTTLTTPTTGPGPGPRPNQAKLLAKKRVVRMLLVIVLLFFVCWLPVYSANTWRAFDGPGARRALAGAPISFIHLLSYTSACANPLVYCFMHRRFRQACLDTCARCCPRPPRARPRPLPDEDPPTPSIASLSRLSYTTISTLGPG
  
Inhibitor
Name:
BDBM50230671
Synonyms:
CHEMBL282056
Type:
Small organic molecule
Emp. Form.:
C31H37N3O3
Mol. Mass.:
499.6438
SMILES:
CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccc1 |TLB:25:24:22:19.18.20,THB:25:19:16.24.23:22,20:21:16:19.18.25,20:19:16:21.23.22,15:16:22:19.18.20,(5.09,-3.82,;5.42,-5.34,;5.33,-6.89,;5.94,-8.29,;5.14,-9.61,;6.12,-10.78,;7.55,-10.18,;8.93,-10.82,;10.2,-9.96,;10.06,-8.42,;8.68,-7.78,;7.41,-8.64,;4.11,-4.5,;2.75,-5.2,;2.66,-6.73,;1.44,-4.36,;.05,-5.04,;-.13,-6.57,;-1.56,-6.75,;-2.83,-6.09,;-4.19,-7.22,;-2.64,-6.98,;-1.3,-7.72,;-2.45,-5.41,;-1.26,-4.31,;-2.66,-4.62,;6.8,-4.64,;6.87,-3.09,;8.09,-5.48,;9.47,-4.78,;10.76,-5.62,;12.14,-4.92,;13.43,-5.76,;14.81,-5.06,;14.91,-3.51,;13.6,-2.67,;12.21,-3.37,)|
Structure:
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