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PubMed code 2769684

Compile data set for download or QSAR
Found 1 hit of Enzyme Inhibition Constant Data   
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
Vitamin K epoxide reductase complex subunit 1


(Bos taurus)		BDBM50018515
PNG
(2-Fluoromethyl-2-hydroxy-3-methyl-3-(3,7,11,15-tet...)
Show SMILES CC(C)CCCC(C)CCCC(C)CCC\C(C)=C\CC1(C)C(=O)c2ccccc2C(=O)C1(O)CF
Show InChI InChI=1S/C32H49FO3/c1-23(2)12-9-13-24(3)14-10-15-25(4)16-11-17-26(5)20-21-31(6)29(34)27-18-7-8-19-28(27)30(35)32(31,36)22-33/h7-8,18-20,23-25,36H,9-17,21-22H2,1-6H3/b26-20+
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PC cid
PC sid
UniChem
PubMed
 1.60E+4n/an/an/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Binding affinity of the compound for vitamin K epoxide reductase

J Med Chem 32: 2138-41 (1989)


BindingDB Entry DOI: 10.7270/Q2513X7Z
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%