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Found 1 hit Enz. Inhib. hit(s) with Target = 'Prothrombin' and Ligand = 'BDBM50210438'   
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
Prothrombin


(Homo sapiens (Human))		BDBM50210438
PNG
((2S,3aS,6R,7aS)-6-hydroxy-1-[(R)-2-((R)-2-hydroxy-...)
Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#8])-[#6]-c1ccccc1)-[#6](=O)-[#7]-1-[#6@H]-2-[#6]-[#6@H](-[#8])-[#6]-[#6]-[#6@H]-2-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7]
Show InChI InChI=1S/C29H46N6O5/c1-18(2)14-22(34-27(39)25(37)15-19-8-4-3-5-9-19)28(40)35-23-17-21(36)11-10-20(23)16-24(35)26(38)32-12-6-7-13-33-29(30)31/h3-5,8-9,18,20-25,36-37H,6-7,10-17H2,1-2H3,(H,32,38)(H,34,39)(H4,30,31,33)/t20-,21+,22+,23-,24-,25+/m0/s1
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PC cid
PC sid
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Similars
Article
PubMed
n/an/a 5.60E+3n/an/an/an/an/an/a



Université de Montréal

Curated by ChEMBL


Assay Description
Inhibition of thrombin

Bioorg Med Chem Lett 17: 3480-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.075
BindingDB Entry DOI: 10.7270/Q25M65FJ
More data for this
Ligand-Target Pair