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Ligand · BYL

BYL · (3R,4R)-4-{4-[6-chloro-2-({1-[(1R)-2,2-difluorocyclopropyl]-5-methyl-1H-pyrazol-4-yl}amino) quinazolin-7-yl]piperidin-1-yl}-4-methyloxolan-3-ol

BYL, (3R,4R)-4-{4-[6-chloro-2-({1-[(1R)-2,2-difluorocyclopropyl]-5-methyl-1H-pyrazol-4-yl}amino) quinazolin-7-yl]piperidin-1-yl}-4-methyloxolan-3-ol (C25 H29 Cl F2 N6 O2, 519.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
BYL
Formula
C25 H29 Cl F2 N6 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

BYL in 2 structures; the first of them:

  • 7SUJ · Structure of CHK1 10-pt. mutant complex with LRRK2 inhibitor 24 · BYL A301 · binds GLN13, LEU15, GLY16, GLU17, GLY18, VAL23, ALA36, MET84 and 12 more
  • 7SUJ · Structure of CHK1 10-pt. mutant complex with LRRK2 inhibitor 24 · BYL A301 · binds GLN13, LEU15, GLY16, GLU17, GLY18, VAL23, ALA36, GLU85 and 9 more

Residues it binds most

GLY 4, LEU 4, ALA 4, GLU 4, ASN 4, GLN 4, HIS 4, LYS 4, SER 4, VAL 4 (residue and the binding sites it lines).

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