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Ligand · 519

519 · 1-(trans-4-{[7-oxo-8-(propan-2-yl)-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl]amino}cyclohexyl)-3-propan-2-ylurea

519, 1-(trans-4-{[7-oxo-8-(propan-2-yl)-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl]amino}cyclohexyl)-3-propan-2-ylurea (C20 H30 N6 O2, 386.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
519
Formula
C20 H30 N6 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

519 in 2 structures; the first of them:

  • 4Y5H · Pyridopyrimidi Derivatives as Potent and Selective c-Jun N-Terminal Kinase (JNK)… · 519 A501 · binds ILE70, GLY71, VAL78, ALA91, ILE124, MET146, GLU147, LEU148 and 7 more
  • 4Y5H · Pyridopyrimidinone derivatives as potent and selective C-jun N- terminal kinase (jnk)… · 519 A501 · binds ILE70, GLY71, VAL78, ALA91, ILE124, MET146, GLU147, LEU148 and 7 more

Residues it binds most

ALA 2, ILE 2, LEU 2, MET 2, VAL 2, ASN 2, ASP 2, GLN 2, GLU 2, GLY 2 (residue and the binding sites it lines).

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