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SMILES: Nc1nc(F)cc2n(cnc12)[C@@H]1CC[C@@H](O)[C@H]1O

InChI Key: InChIKey=KNQJREJPOCVQIL-LIGPWKHUSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50018506   
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
Adenosylhomocysteinase


(Homo sapiens (Human))		BDBM50018506
PNG
(CHEMBL3290656)
Show SMILES Nc1nc(F)cc2n(cnc12)[C@@H]1CC[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C11H13FN4O2/c12-8-3-6-9(11(13)15-8)14-4-16(6)5-1-2-7(17)10(5)18/h3-5,7,10,17-18H,1-2H2,(H2,13,15)/t5-,7-,10+/m1/s1
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Article
PubMed
n/an/a 4.83E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of recombinant human AHCY using SAH as substrate assessed as formation of homocysteine after 10 mins

Bioorg Med Chem Lett 24: 2737-40 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.034
BindingDB Entry DOI: 10.7270/Q2VM4DTT
More data for this
Ligand-Target Pair