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Target
B1 bradykinin receptor
Ligand
BDBM50210363
Substrate
n/a
Meas. Tech.
ChEMBL_443978 (CHEMBL893140)
Ki
3.7±n/a nM
Citation
 Su, DS; Lim, JL; Markowitz, MK; Wan, BL; Murphy, KL; Reiss, DR; Harrell, CM; O'Malley, SS; Ransom, RW; Chang, RS; Pettibone, DJ; Tang, C; Prueksaritanont, T; Freidinger, RM; Bock, MG Potent bradykinin B1 receptor antagonists: 4-substituted phenyl cyclohexanes. Bioorg Med Chem Lett 17:3006-9 (2007) [PubMed]  Article
Target
Name:
B1 bradykinin receptor
Synonyms:
B1 BRADYKININ | B1 bradykinin receptor | B1R | BDKRB1 | BK-1 receptor | BKRB1_HUMAN | BRADYB1 | Bradykinin B1 receptor
Type:
Enzyme
Mol. Mass.:
40508.87
Organism:
Homo sapiens (Human)
Description:
P46663
Residue:
353
Sequence:
MASSWPPLELQSSNQSQLFPQNATACDNAPEAWDLLHRVLPTFIISICFFGLLGNLFVLLVFLLPRRQLNVAEIYLANLAASDLVFVLGLPFWAENIWNQFNWPFGALLCRVINGVIKANLFISIFLVVAISQDRYRVLVHPMASRRQQRRRQARVTCVLIWVVGGLLSIPTFLLRSIQAVPDLNITACILLLPHEAWHFARIVELNILGFLLPLAAIVFFNYHILASLRTREEVSRTRCGGRKDSKTTALILTLVVAFLVCWAPYHFFAFLEFLFQVQAVRGCFWEDFIDLGLQLANFFAFTNSSLNPVIYVFVGRLFRTKVWELYKQCTPKSLAPISSSHRKEIFQLFWRN
  
Inhibitor
Name:
BDBM50210363
Synonyms:
CHEMBL233886 | N-(2-((4-(2-chlorophenyl)-4-cyanocyclohexyl)methylamino)pyridin-3-yl)-3,3,3-trifluoropropanamide
Type:
Small organic molecule
Emp. Form.:
C22H22ClF3N4O
Mol. Mass.:
450.884
SMILES:
FC(F)(F)CC(=O)Nc1cccnc1NCC1CCC(CC1)(C#N)c1ccccc1Cl |(4.04,-13.65,;5.38,-14.42,;6.15,-13.09,;4.62,-15.75,;6.71,-15.19,;6.71,-16.73,;5.38,-17.49,;8.04,-17.51,;8.05,-19.05,;6.71,-19.81,;6.71,-21.36,;8.05,-22.13,;9.38,-21.36,;9.38,-19.81,;10.71,-19.03,;12.04,-18.25,;13.38,-19.01,;13.4,-20.56,;14.72,-21.33,;16.08,-20.52,;16.06,-18.98,;14.71,-18.23,;17.34,-19.63,;18.59,-18.74,;16.15,-22.05,;17.5,-22.77,;17.57,-24.31,;16.27,-25.12,;14.91,-24.41,;14.84,-22.87,;13.47,-22.16,)|
Structure:
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