GtoPdb Ligand ID: 8230

Compound class: Synthetic organic
Comment: IOX1 is a cell-permeable, broad-spectrum 2-oxoglutarate oxygenase inhibitor [1]. This is a compound from the Structural Genomics Consortium's (SGC) Epigenetics Probes Collection.
2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 70.42
Molecular weight 189.04
XLogP 1.33
No. Lipinski's rules broken 0
Canonical SMILES OC(=O)c1ccc(c2c1cccn2)O
Isomeric SMILES OC(=O)c1ccc(c2c1cccn2)O
InChI InChI=1S/C10H7NO3/c12-8-4-3-7(10(13)14)6-2-1-5-11-9(6)8/h1-5,12H,(H,13,14)
Selectivity at enzymes
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
lysine demethylase 3A Hs Inhibitor Inhibition 7.0 pIC50 - 1
pIC50 7.0 (IC50 1x10-7 M) [1]
lysine demethylase 4C Hs Inhibitor Inhibition 6.2 pIC50 - 1
pIC50 6.2 (IC50 6x10-7 M) [1]
lysine demethylase 6B Hs Inhibitor Inhibition 5.8 pIC50 - 1
pIC50 5.8 (IC50 1.6x10-6 M) [1]
egl-9 family hypoxia inducible factor 1 Hs Inhibitor Inhibition 4.5 pIC50 - 1
pIC50 4.5 (IC50 3.3x10-5 M) [1]