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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Coagulation factor X' and Ligand = 'BDBM14158'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Coagulation factor X


(Homo sapiens (Human))
BDBM14158
PNG
(APC-11922 | CHEMBL293260 | N-(4-carbamimidoyl-3-fl...)
Show SMILES Cc1cc(I)c(O)c(c1)C(=O)Nc1ccc(C(N)=N)c(F)c1
Show InChI InChI=1S/C15H13FIN3O2/c1-7-4-10(13(21)12(17)5-7)15(22)20-8-2-3-9(14(18)19)11(16)6-8/h2-6,21H,1H3,(H3,18,19)(H,20,22)
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PC cid
PC sid
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Similars

Article
PubMed
500n/an/an/an/an/an/an/an/a



Axys Pharmaceutical



Assay Description
Each enzyme was assayed with a set of different concentrations of each inhibitor. After addition of the appropriate substrate, the rate of hydrolysis...


Chem Biol 8: 1107-21 (2001)


Article DOI: 10.1016/S1074-5521(01)00084-9
BindingDB Entry DOI: 10.7270/Q2S75DKN
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM14158
PNG
(APC-11922 | CHEMBL293260 | N-(4-carbamimidoyl-3-fl...)
Show SMILES Cc1cc(I)c(O)c(c1)C(=O)Nc1ccc(C(N)=N)c(F)c1
Show InChI InChI=1S/C15H13FIN3O2/c1-7-4-10(13(21)12(17)5-7)15(22)20-8-2-3-9(14(18)19)11(16)6-8/h2-6,21H,1H3,(H3,18,19)(H,20,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
520n/an/an/an/an/an/an/an/a



Celera

Curated by ChEMBL


Assay Description
Inhibition of coagulation factor X


Bioorg Med Chem Lett 12: 2023-6 (2002)


BindingDB Entry DOI: 10.7270/Q2ZG6RK4
More data for this
Ligand-Target Pair