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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for UniProtKB: P01008   
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
Antithrombin-III/Coagulation factor X


(Homo sapiens (Human))		BDBM50393527
PNG
(CHEMBL2158198)
Show SMILES OS(=O)(=O)OC[C@H]1O[C@@H](Oc2ccc3c(c2)oc2cc(O[C@@H]4O[C@H](COS(O)(=O)=O)[C@@H](OS(O)(=O)=O)[C@H](OS(O)(=O)=O)[C@H]4OS(O)(=O)=O)ccc2c3=O)[C@H](OS(O)(=O)=O)[C@@H](OS(O)(=O)=O)[C@@H]1OS(O)(=O)=O |r|
Show InChI InChI=1S/C25H28O38S8/c26-17-11-3-1-9(53-24-22(62-70(45,46)47)20(60-68(39,40)41)18(58-66(33,34)35)15(56-24)7-51-64(27,28)29)5-13(11)55-14-6-10(2-4-12(14)17)54-25-23(63-71(48,49)50)21(61-69(42,43)44)19(59-67(36,37)38)16(57-25)8-52-65(30,31)32/h1-6,15-16,18-25H,7-8H2,(H,27,28,29)(H,30,31,32)(H,33,34,35)(H,36,37,38)(H,39,40,41)(H,42,43,44)(H,45,46,47)(H,48,49,50)/t15-,16-,18-,19-,20+,21+,22-,23-,24-,25-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

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DrugBank
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KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.90E+5n/an/an/an/an/an/a



Universidade do Porto (CEQUIMED-UP)

Curated by ChEMBL


Assay Description
Inhibition of human factor 10a/antithrombin 3 assessed as CBS 31.39 substrate hydrolysis by spectrophotometric analysis

J Med Chem 54: 5373-84 (2011)


Article DOI: 10.1021/jm2006589
BindingDB Entry DOI: 10.7270/Q27P90HT
More data for this
Ligand-Target Pair