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BDBM352471 US9809545, 4Ar

SMILES: Fc1ccc(CC(c2ncc([nH]2)-c2ccc(nc2)C(F)(F)F)n2ccc(cc2=O)-c2cc(Cl)ccc2-n2cnnn2)cc1

InChI Key:

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 352471   
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
Coagulation factor IX


(Homo sapiens (Human))
BDBM352471
PNG
(US9809545, 4Ar)
Show SMILES Fc1ccc(CC(c2ncc([nH]2)-c2ccc(nc2)C(F)(F)F)n2ccc(cc2=O)-c2cc(Cl)ccc2-n2cnnn2)cc1
PDB
MMDB

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PC cid
PC sid
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US Patent
275n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Factor XIa determinations were made in 50 mM HEPES buffer at pH 7.4 containing 150 mM NaCl, 5 mM CaCl2, and 0.1% PEG 8000 (polyethylene glycol; JT Ba...


US Patent US9809545 (2017)


BindingDB Entry DOI: 10.7270/Q24Q7X4Q
More data for this
Ligand-Target Pair