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Target
B1 bradykinin receptor
Ligand
BDBM50210359
Substrate
n/a
Meas. Tech.
ChEMBL_443978 (CHEMBL893140)
Ki
4.9±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:
BDBM50210359
Synonyms:
CHEMBL234720 | N-(2-((4-cyano-4-(2,3-dichlorophenyl)cyclohexyl)methylamino)pyridin-3-yl)-3,3,3-trifluoropropanamide
Type:
Small organic molecule
Emp. Form.:
C22H21Cl2F3N4O
Mol. Mass.:
485.33
SMILES:
FC(F)(F)CC(=O)Nc1cccnc1NCC1CCC(CC1)(C#N)c1cccc(Cl)c1Cl |(-11.15,-15.2,;-9.81,-15.97,;-9.04,-14.64,;-10.57,-17.3,;-8.48,-16.74,;-8.48,-18.27,;-9.81,-19.04,;-7.15,-19.05,;-7.14,-20.59,;-8.48,-21.36,;-8.48,-22.91,;-7.14,-23.68,;-5.81,-22.91,;-5.81,-21.36,;-4.48,-20.58,;-3.15,-19.8,;-1.8,-20.56,;-1.79,-22.11,;-.47,-22.88,;.89,-22.07,;.87,-20.53,;-.48,-19.78,;2.19,-21.23,;3.47,-20.39,;.89,-23.6,;2.22,-24.38,;2.21,-25.92,;.88,-26.68,;-.45,-25.91,;-1.78,-26.67,;-.45,-24.36,;-1.78,-23.59,)|
Structure:
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