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BDBM50295597 5-chloro-N-((3R,5S)-1-(2-(2-fluoro-4-(2-oxopyridin-1(2H)-yl)phenylamino)-2-oxoethyl)-5-(methoxymethyl)pyrrolidin-3-yl)thiophene-2-carboxamide::CHEMBL559033

SMILES: COC[C@@H]1C[C@H](CN1CC(=O)Nc1ccc(cc1F)-n1ccccc1=O)NC(=O)c1ccc(Cl)s1

InChI Key: InChIKey=HGCJGAPVUFDYJO-WBVHZDCISA-N

Data: 1 KI

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50295597   
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))
BDBM50295597
PNG
(5-chloro-N-((3R,5S)-1-(2-(2-fluoro-4-(2-oxopyridin...)
Show SMILES COC[C@@H]1C[C@H](CN1CC(=O)Nc1ccc(cc1F)-n1ccccc1=O)NC(=O)c1ccc(Cl)s1 |r|
Show InChI InChI=1S/C24H24ClFN4O4S/c1-34-14-17-10-15(27-24(33)20-7-8-21(25)35-20)12-29(17)13-22(31)28-19-6-5-16(11-18(19)26)30-9-3-2-4-23(30)32/h2-9,11,15,17H,10,12-14H2,1H3,(H,27,33)(H,28,31)/t15-,17+/m1/s1
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MMDB

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Similars

Article
PubMed
94n/an/an/an/an/an/an/an/a



F Hoffmann - La Roche Ltd

Curated by ChEMBL


Assay Description
Binding affinity to factor 10a


Eur J Med Chem 44: 2787-95 (2009)


Article DOI: 10.1016/j.ejmech.2008.12.025
BindingDB Entry DOI: 10.7270/Q2CV4HSP
More data for this
Ligand-Target Pair