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Found 1 hit Enz. Inhib. hit(s) with Target = 'Prothrombin' and Ligand = 'BDBM50269528'   
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))		BDBM50269528
PNG
((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl...)
Show SMILES [#6]-[#6](=O)-[#8]-[#6@@H]1-[#6]-[#6][C@]2([#6])[#6@H]-3-[#6]-[#6@H](-[#8])[C@@]4([#6])[#6@H]-5-[#6@H](-[#6][C@]4([#6]-[#8])[#6]-3=[#6]-[#6]-[#6@H]2[C@]1([#6])[#6](=O)-[#8]-[#6@@H]-1-[#8]-[#6@H](-[#6]-[#8])-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-1-[#8])-[#8]-[#6](=O)-[#6@@H]-5-[#6]-[#6](=O)\[#6]=[#6](\[#6])-[#6] |r,c:23|
Show InChI InChI=1S/C38H54O14/c1-17(2)11-19(42)12-20-28-23(50-32(20)47)14-38(16-40)21-7-8-25-35(4,22(21)13-26(43)37(28,38)6)10-9-27(49-18(3)41)36(25,5)34(48)52-33-31(46)30(45)29(44)24(15-39)51-33/h7,11,20,22-31,33,39-40,43-46H,8-10,12-16H2,1-6H3/t20-,22+,23+,24-,25-,26+,27-,28-,29-,30+,31-,33+,35-,36+,37+,38+/m1/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 130n/an/an/an/an/an/a



GlaxoWellcome Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human thrombin by fibrinogen-clot assay

J Nat Prod 61: 1328-31 (1999)


Article DOI: 10.1021/np970464j
BindingDB Entry DOI: 10.7270/Q2X63MQ2
More data for this
Ligand-Target Pair