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BDBM150287 US8987242, 67

SMILES: CC(C)(C)c1ccc(cc1)N1CCO[C@H]([C@@H](O)C(=O)Nc2ccc(cc2F)C(N)=N)C1=O

InChI Key: InChIKey=YRRLJODQLNZJFI-RTBURBONSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 150287   
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))
BDBM150287
PNG
(US8987242, 67)
Show SMILES CC(C)(C)c1ccc(cc1)N1CCO[C@H]([C@@H](O)C(=O)Nc2ccc(cc2F)C(N)=N)C1=O |r|
Show InChI InChI=1S/C23H27FN4O4/c1-23(2,3)14-5-7-15(8-6-14)28-10-11-32-19(22(28)31)18(29)21(30)27-17-9-4-13(20(25)26)12-16(17)24/h4-9,12,18-19,29H,10-11H2,1-3H3,(H3,25,26)(H,27,30)/t18-,19-/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 60n/an/an/an/a8.025



Merck Sharp & Dohme Corp.; Mochida Pharmaceuticals Co., Ltd.

US Patent


Assay Description
Inhibitory activity against factor IXa was tested using the substrate SPECTROFLUOR FIXa (american diagnostica inc.; 500 West Avenue, Stamford, Conn. ...


US Patent US8987242 (2015)


BindingDB Entry DOI: 10.7270/Q2ZW1JNS
More data for this
Ligand-Target Pair