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BDBM50140439 2-(3-Fluoro-naphthalen-2-yl)-5-methyl-2H-pyrazole-3-carboxylic acid [4-(azetidin-1-yl-imino-methyl)-2-fluoro-phenyl]-amide::CHEMBL428530

SMILES: Cc1cc(C(=O)Nc2ccc(cc2F)C(=N)N2CCC2)n(n1)-c1cc2ccccc2cc1F

InChI Key: InChIKey=QOOHZKNFUNSLBV-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50140439   
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 X


(Homo sapiens (Human))
BDBM50140439
PNG
(2-(3-Fluoro-naphthalen-2-yl)-5-methyl-2H-pyrazole-...)
Show SMILES Cc1cc(C(=O)Nc2ccc(cc2F)C(=N)N2CCC2)n(n1)-c1cc2ccccc2cc1F
Show InChI InChI=1S/C25H21F2N5O/c1-15-11-23(32(30-15)22-14-17-6-3-2-5-16(17)12-20(22)27)25(33)29-21-8-7-18(13-19(21)26)24(28)31-9-4-10-31/h2-3,5-8,11-14,28H,4,9-10H2,1H3,(H,29,33)
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Article
PubMed
n/an/a 50n/an/an/an/an/an/a



Millennium Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human coagulation factor X


Bioorg Med Chem Lett 14: 1229-34 (2004)


Article DOI: 10.1016/j.bmcl.2003.12.054
BindingDB Entry DOI: 10.7270/Q2QN6664
More data for this
Ligand-Target Pair