GL1X · GenesisL1 explorer

Ligand · UOE

UOE · (2~{R})-2-[5-[5-chloranyl-2-(oxan-4-ylamino)pyrimidin-4-yl]-3-oxidanylidene-1~{H}-isoindol-2-yl]-~{N}-[(1~{S})-1-[6-(4-methylpiperazin-1-yl)pyridin-2-yl]-2-oxidanyl-ethyl]propanamide

UOE, (2~{R})-2-[5-[5-chloranyl-2-(oxan-4-ylamino)pyrimidin-4-yl]-3-oxidanylidene-1~{H}-isoindol-2-yl]-~{N}-[(1~{S})-1-[6-(4-methylpiperazin-1-yl)pyridin-2-yl]-2-oxidanyl-ethyl]propanamide (C32 H39 Cl N8 O4, 635.2 g/mol), in the MolNFT…

Component
UOE
Formula
C32 H39 Cl N8 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

UOE in 2 structures; the first of them:

  • 7NR8 · Discovery of ASTX029, a clinical candidate which modulates the phosphorylation and… · UOE A408 · binds ILE31, ALA35, TYR36, VAL39, ALA52, LYS54, ILE56, TYR64 and 16 more
  • 7NR8 · Discovery of ASTX029, a clinical candidate which modulates the phosphorylation and… · UOE A408 · binds ILE31, ALA35, TYR36, VAL39, ALA52, LYS54, ILE56, TYR64 and 16 more

Residues it binds most

ASP 2, ILE 2, ALA 2, GLU 2, LEU 2, LYS 2, THR 2, TYR 2, ARG 2, CYS 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol

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