Reaction Details Report a problem with these data
Target
B2 bradykinin receptor
Ligand
BDBM50182459
Substrate
n/a
Meas. Tech.
ChEMBL_333385 (CHEMBL859129)
Ki
>10000±n/a nM
Citation
Wood, MR; Schirripa, KM; Kim, JJ; Wan, BL; Murphy, KL; Ransom, RW; Chang, RS; Tang, C; Prueksaritanont, T; Detwiler, TJ; Hettrick, LA; Landis, ER; Leonard, YM; Krueger, JA; Lewis, SD; Pettibone, DJ; Freidinger, RM; Bock, MG Cyclopropylamino acid amide as a pharmacophoric replacement for 2,3-diaminopyridine. Application to the design of novel bradykinin B1 receptor antagonists. J Med Chem 49:1231-4 (2006) [PubMed] Article
More Info.:
Target
Name:
B2 bradykinin receptor
Synonyms:
B2 BRADYKININ | B2 bradykinin receptor | B2R | BDKRB2 | BK-2 receptor | BKR2 | BKRB2_HUMAN | Bradykinin B2 receptor
Type:
Enzyme Catalytic Domain
Mol. Mass.:
44467.17
Organism:
Homo sapiens (Human)
Description:
B2 BRADYKININ BDKRB2 HUMAN::P30411
Residue:
391
Sequence:
MFSPWKISMFLSVREDSVPTTASFSADMLNVTLQGPTLNGTFAQSKCPQVEWLGWLNTIQPPFLWVLFVLATLENIFVLSVFCLHKSSCTVAEIYLGNLAAADLILACGLPFWAITISNNFDWLFGETLCRVVNAIISMNLYSSICFLMLVSIDRYLALVKTMSMGRMRGVRWAKLYSLVIWGCTLLLSSPMLVFRTMKEYSDEGHNVTACVISYPSLIWEVFTNMLLNVVGFLLPLSVITFCTMQIMQVLRNNEMQKFKEIQTERRATVLVLVVLLLFIICWLPFQISTFLDTLHRLGILSSCQDERIIDVITQIASFMAYSNSCLNPLVYVIVGKRFRKKSWEVYQGVCQKGGCRSEPIQMENSMGTLRTSISVERQIHKLQDWAGSRQ
Inhibitor
Name:
BDBM50182459
Synonyms:
CHEMBL201717 | methyl 4'-[({2-methyl-2-[(3,3,3-trifluoropropanoyl)amino]propanoyl}amino)-methyl]-1,1'-biphenyl-2-carboxylate
Type:
Small organic molecule
Emp. Form.:
C22H23F3N2O4
Mol. Mass.:
436.4242
SMILES:
COC(=O)c1ccccc1-c1ccc(CNC(=O)C(C)(C)NC(=O)CC(F)(F)F)cc1