Reaction Details Report a problem with these data
Target
B1 bradykinin receptor
Ligand
BDBM50264530
Substrate
n/a
Meas. Tech.
ChEMBL_535280 (CHEMBL982605)
IC50
>5000±n/a nM
Citation
Guo, Q; Chandrasekhar, J; Ihle, D; Wustrow, DJ; Chenard, BL; Krause, JE; Hutchison, A; Alderman, D; Cheng, C; Cortright, D; Broom, D; Kershaw, MT; Simmermacher-Mayer, J; Peng, Y; Hodgetts, KJ 1-Benzylbenzimidazoles: the discovery of a novel series of bradykinin B(1) receptor antagonists. Bioorg Med Chem Lett 18:5027-31 (2008) [PubMed] Article
More Info.:
Target
Name:
B1 bradykinin receptor
Synonyms:
BDKRB1 | BKRB1_MACFA
Type:
PROTEIN
Mol. Mass.:
40231.64
Organism:
Macaca fascicularis
Description:
ChEMBL_535280
Residue:
352
Sequence:
MASWPPLQLQSSNQSQLFPQNATACDNAPEAWDLLHRVLPTFIISICSFGLLGNLFVLLVFLLPRRRLNVAEIYLANLAASDLVFVLGLPFWAENIWNQFNWPFGALLCRVINGIIKANLFISIFLVVAISQDRYCVLVHPMASRRRQRRRQARVTCVLIWVVGGLLSIPTFLLRSIQAVPDLNITACILLLPHEAWHFARIVELNILAFLLPLAAIIFFNYHILASLRGREEVSRTRCGGSKDSKTTALILTLVVAFLVCWAPYHFFAFLEFLFQVQAVRGCFWEDFIDLGLQLANFLAFTNSSLNPVIYVFAGRLFRTKVWELYKQCTPKSLAPISSSHRKEIFQLFWRN
Inhibitor
Name:
BDBM50264530
Synonyms:
(1-Benzyl-1H-benzoimidazol-2-yl)-[(S)-2-(4-pyridin-4-yl-piperazine-1-carbonyl)-pyrrolidin-1-yl]-methanone | CHEMBL520461
Type:
Small organic molecule
Emp. Form.:
C29H30N6O2
Mol. Mass.:
494.5875
SMILES:
O=C([C@@H]1CCCN1C(=O)c1nc2ccccc2n1Cc1ccccc1)N1CCN(CC1)c1ccncc1 |r|