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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 50125971   
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 IX


(Homo sapiens (Human))
BDBM50125971
PNG
(CHEMBL3627893)
Show SMILES Cc1ncn(n1)-c1cc(Cl)c(C(=O)NC[C@H](c2nc3cc(C)c(Cl)cc3[nH]2)c2cccc(F)c2)c(Cl)c1 |r|
Show InChI InChI=1S/C26H20Cl3FN6O/c1-13-6-22-23(10-19(13)27)34-25(33-22)18(15-4-3-5-16(30)7-15)11-31-26(37)24-20(28)8-17(9-21(24)29)36-12-32-14(2)35-36/h3-10,12,18H,11H2,1-2H3,(H,31,37)(H,33,34)/t18-/m0/s1
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PC cid
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Similars

Article
PubMed
14n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human coagulation factor 9a using fluorescent peptide CH3SO2-D-CHG-Gly-Arg-AFC-AcoH as substrate


Bioorg Med Chem Lett 25: 4945-9 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.057
BindingDB Entry DOI: 10.7270/Q20Z753B
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50125971
PNG
(CHEMBL3627893)
Show SMILES Cc1ncn(n1)-c1cc(Cl)c(C(=O)NC[C@H](c2nc3cc(C)c(Cl)cc3[nH]2)c2cccc(F)c2)c(Cl)c1 |r|
Show InChI InChI=1S/C26H20Cl3FN6O/c1-13-6-22-23(10-19(13)27)34-25(33-22)18(15-4-3-5-16(30)7-15)11-31-26(37)24-20(28)8-17(9-21(24)29)36-12-32-14(2)35-36/h3-10,12,18H,11H2,1-2H3,(H,31,37)(H,33,34)/t18-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
1.52E+4n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human coagulation factor 10a using fluorescent peptide nAcetyl-KPR-AFC as substrate


Bioorg Med Chem Lett 25: 4945-9 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.057
BindingDB Entry DOI: 10.7270/Q20Z753B
More data for this
Ligand-Target Pair