Reaction Details Report a problem with these data
Target
Gastrin/cholecystokinin type B receptor
Ligand
BDBM50285624
Substrate
n/a
Meas. Tech.
ChEMBL_40189 (CHEMBL652236)
Kd
0.110000±n/a nM
Citation
 Horwell, D; Hunter, J; Kneen, C; Pritchard, M Synthesis of novel iodinated radioligands with high affinity and selectivity for CCK-B/gastrin receptors Bioorg Med Chem Lett 5:2501-2506 (1995)    Article 
Target
Name:
Gastrin/cholecystokinin type B receptor
Synonyms:
CCK-2 receptor | CCK-B receptor | CCK-BR | CCKBR | CCKRB | Cholecystokinin A | Cholecystokinin receptor | Cholecystokinin-2 Receptor | GASR_HUMAN | Gastrin/cholecystokinin type B receptor
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
48445.79
Organism:
Homo sapiens (Human)
Description:
Stable expression of human CCK-2 receptors in HEK 293 cells.
Residue:
447
Sequence:
MELLKLNRSVQGTGPGPGASLCRPGAPLLNSSSVGNLSCEPPRIRGAGTRELELAIRITLYAVIFLMSVGGNMLIIVVLGLSRRLRTVTNAFLLSLAVSDLLLAVACMPFTLLPNLMGTFIFGTVICKAVSYLMGVSVSVSTLSLVAIALERYSAICRPLQARVWQTRSHAARVIVATWLLSGLLMVPYPVYTVVQPVGPRVLQCVHRWPSARVRQTWSVLLLLLLFFIPGVVMAVAYGLISRELYLGLRFDGDSDSDSQSRVRNQGGLPGAVHQNGRCRPETGAVGEDSDGCYVQLPRSRPALELTALTAPGPGSGSRPTQAKLLAKKRVVRMLLVIVVLFFLCWLPVYSANTWRAFDGPGAHRALSGAPISFIHLLSYASACVNPLVYCFMHRRFRQACLETCARCCPRPPRARPRALPDEDPPTPSIASLSRLSYTTISTLGPG
  
Inhibitor
Name:
BDBM50285624
Synonyms:
(R)-3-[(R)-2-(Adamantan-2-yloxycarbonylamino)-3-(1H-indol-3-yl)-2-methyl-propionylamino]-4-(4-amino-phenyl)-butyric acid | CHEMBL83942
Type:
Small organic molecule
Emp. Form.:
C33H40N4O5
Mol. Mass.:
572.6945
SMILES:
C[C@](Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)N[C@@H](CC(O)=O)Cc1ccc(N)cc1 |wU:1.0,wD:1.13,29.33,TLB:15:16:18:21.22.20,THB:23:24:18:21.22.20,23:21:18:16.24.25,20:21:16:19.18.25,20:19:16:21.22.23,(1.46,-10.74,;2.81,-11.49,;4.14,-10.72,;4.12,-9.18,;5.39,-10.05,;6.61,-9.11,;6.1,-7.67,;6.83,-6.34,;6.05,-5.01,;4.51,-5.06,;3.76,-6.38,;4.56,-7.69,;2.84,-13.03,;1.53,-13.82,;1.55,-15.36,;.18,-13.1,;-1.11,-13.94,;-2.49,-13.35,;-3.84,-13.85,;-3.84,-15.32,;-5.02,-16.6,;-3.53,-16.15,;-3.53,-14.59,;-2.13,-16.74,;-1.11,-15.45,;-2.5,-15.8,;3.91,-12.56,;5.45,-12.56,;3.94,-14.1,;5.29,-14.85,;5.33,-16.39,;4.02,-17.2,;4.06,-18.74,;2.67,-16.47,;6.61,-14.06,;7.95,-14.8,;7.99,-16.34,;9.33,-17.06,;10.64,-16.27,;11.99,-17.02,;10.61,-14.73,;9.27,-13.98,)|
Structure:
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