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Target
B1 bradykinin receptor
Ligand
BDBM50210372
Substrate
n/a
Meas. Tech.
ChEMBL_443978 (CHEMBL893140)
Ki
18±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:
BDBM50210372
Synonyms:
CHEMBL234296 | N-(2-((4-cyano-4-(2-fluorophenyl)cyclohexyl)methylamino)pyridin-3-yl)-3,3,3-trifluoropropanamide
Type:
Small organic molecule
Emp. Form.:
C22H22F4N4O
Mol. Mass.:
434.4299
SMILES:
Fc1ccccc1C1(CCC(CNc2ncccc2NC(=O)CC(F)(F)F)CC1)C#N |(-3.57,-32.99,;-2.04,-32.97,;-1.24,-34.29,;.29,-34.27,;1.05,-32.93,;.26,-31.61,;-1.28,-31.62,;-2.06,-30.31,;-3.42,-31.12,;-4.74,-30.35,;-4.76,-28.8,;-6.11,-28.04,;-7.43,-28.82,;-8.76,-29.6,;-8.76,-31.15,;-10.09,-31.92,;-11.43,-31.15,;-11.43,-29.6,;-10.09,-28.84,;-10.1,-27.3,;-11.43,-26.52,;-12.77,-27.29,;-11.43,-24.98,;-12.77,-24.22,;-14.1,-23.45,;-12,-22.88,;-13.54,-25.55,;-3.44,-28.02,;-2.09,-28.77,;-.78,-29.45,;.49,-28.59,)|
Structure:
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