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Target
B1 bradykinin receptor
Ligand
BDBM50210364
Substrate
n/a
Meas. Tech.
ChEMBL_443978 (CHEMBL893140)
Ki
3.6±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:
BDBM50210364
Synonyms:
CHEMBL233887 | N-(2-((4-cyano-4-(2-(trifluoromethoxy)phenyl)cyclohexyl)methylamino)pyridin-3-yl)-3,3,3-trifluoropropanamide
Type:
Small organic molecule
Emp. Form.:
C23H22F6N4O2
Mol. Mass.:
500.4368
SMILES:
FC(F)(F)CC(=O)Nc1cccnc1NCC1CCC(CC1)(C#N)c1ccccc1OC(F)(F)F |(20.88,-14.74,;22.21,-15.51,;22.98,-14.17,;21.45,-16.84,;23.55,-16.28,;23.55,-17.82,;22.21,-18.59,;24.87,-18.6,;24.89,-20.14,;23.55,-20.91,;23.55,-22.46,;24.89,-23.23,;26.22,-22.46,;26.22,-20.91,;27.54,-20.13,;28.87,-19.35,;30.22,-20.11,;30.24,-21.66,;31.56,-22.43,;32.92,-21.62,;32.9,-20.08,;31.55,-19.33,;34.21,-20.78,;35.49,-19.92,;33.7,-22.94,;35.23,-22.95,;36.01,-24.27,;35.24,-25.61,;33.7,-25.61,;32.92,-24.28,;31.38,-24.28,;30.69,-25.67,;29.91,-26.99,;32.05,-26.4,;29.34,-24.94,)|
Structure:
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