Ki Summary

Reaction Details

Report a problem with these data

Target

Gastrin/cholecystokinin type B receptor

Ligand

BDBM50230670

Substrate

n/a

Meas. Tech.

ChEMBL_48424 (CHEMBL660352)

93±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

More Info.:

Get all data from this article, Assay Method

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:

BDBM50230670

Synonyms:

CHEMBL3350394

Type:

Small organic molecule

Emp. Form.:

C32H37N3O5

Mol. Mass.:

543.6533

SMILES:

OC(=O)C[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC1C2CC3CC(C2)CC1C3 |wU:15.16,wD:4.4,TLB:39:38:36:33.32.34,THB:39:33:30.38.37:36,34:35:30:33.32.39,34:33:30:35.37.36,29:30:36:33.32.34,(-1.66,-13.17,;-2.02,-11.68,;-3.5,-11.24,;-.91,-10.61,;.57,-11.05,;.93,-12.54,;2.41,-12.98,;3.53,-11.91,;5,-12.35,;5.37,-13.84,;4.25,-14.91,;2.78,-14.47,;1.69,-9.98,;1.32,-8.49,;-.16,-8.05,;2.44,-7.42,;3.97,-7.38,;4.78,-8.69,;4.2,-10.11,;5.37,-11.11,;6.68,-10.3,;8.16,-10.74,;9.27,-9.67,;8.91,-8.18,;7.43,-7.74,;6.32,-8.81,;2.07,-5.93,;3.19,-4.86,;4.66,-5.3,;2.82,-3.37,;3.94,-2.3,;5.31,-1.61,;5.31,-.21,;6.15,1.26,;7.52,.57,;7.52,-.83,;6.68,-2.3,;6.15,-1.53,;4.78,-.83,;4.78,.57,)|

Structure: