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BDBM140557 US8912221, 30

SMILES: C[C@@H](NC(=O)C1(COC1)NC(=O)c1cccnc1)c1ncc(cc1F)-c1cc(Cl)cc(F)c1-c1noc(C)n1

InChI Key: InChIKey=RQARWLFYEUNZFN-UGPWUYPHNA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 140557   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Bradykinin B1 receptor


(Homo sapiens (Human))
BDBM140557
PNG
(US8912221, 30)
Show SMILES C[C@@H](NC(=O)C1(COC1)NC(=O)c1cccnc1)c1ncc(cc1F)-c1cc(Cl)cc(F)c1-c1noc(C)n1
Show InChI InChI=1/C26H21ClF2N6O4/c1-13(32-25(37)26(11-38-12-26)34-24(36)15-4-3-5-30-9-15)22-20(29)6-16(10-31-22)18-7-17(27)8-19(28)21(18)23-33-14(2)39-35-23/h3-10,13H,11-12H2,1-2H3,(H,32,37)(H,34,36)/t13-/s2
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
1.30n/an/an/an/an/an/a7.4n/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
For binding, Bradykinin-1 receptor antagonist compounds were added in various concentrations in 50 mM Tris pH 7.4, 5 mM MgCl2 together with 6 nM Kall...


US Patent US8912221 (2014)


BindingDB Entry DOI: 10.7270/Q2668BWC
More data for this
Ligand-Target Pair