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BDBM50144090 CHEMBL62563::[4-(6-Bromo-naphthalene-2-sulfonyl)-piperazin-1-yl]-[4-(imino-morpholin-4-yl-methyl)-phenyl]-methanone

SMILES: Brc1ccc2cc(ccc2c1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccc(cc1)C(=N)N1CCOCC1

InChI Key: InChIKey=JMQKFPYHLCESRV-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50144090   
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))
BDBM50144090
PNG
(CHEMBL62563 | [4-(6-Bromo-naphthalene-2-sulfonyl)-...)
Show SMILES Brc1ccc2cc(ccc2c1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccc(cc1)C(=N)N1CCOCC1
Show InChI InChI=1S/C26H27BrN4O4S/c27-23-7-5-22-18-24(8-6-21(22)17-23)36(33,34)31-11-9-30(10-12-31)26(32)20-3-1-19(2-4-20)25(28)29-13-15-35-16-14-29/h1-8,17-18,28H,9-16H2
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MMDB

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Article
PubMed
n/an/a 640n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair