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Ligand · 094

094 · 1-(2,6-dichlorophenyl)-6-[(2,4-difluorophenyl)sulfanyl]-7-(1,2,3,6-tetrahydro-4-pyridinyl)-3,4-dihydropyrido[3,2-d]pyrimidin-2(1H)-one

094, 1-(2,6-dichlorophenyl)-6-[(2,4-difluorophenyl)sulfanyl]-7-(1,2,3,6-tetrahydro-4-pyridinyl)-3,4-dihydropyrido[3,2-d]pyrimidin-2(1H)-one (C24 H18 Cl2 F2 N4 O S, 519.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component
094
Formula
C24 H18 Cl2 F2 N4 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

094 in 2 structures; the first of them:

  • 1OUY · The structure of p38 alpha in complex with a dihydropyrido-pyrimidine inhibitor · 094 A501 · binds VAL30, TYR35, VAL38, ALA51, VAL52, LYS53, LEU75, ILE84 and 13 more
  • 1OUY · The structure of P38 alpha in complex with a dihydropyrido-pyrimidine inhibitor · 094 A501 · binds VAL30, TYR35, VAL38, ALA51, VAL52, LYS53, LEU75, ILE84 and 13 more

Residues it binds most

LEU 2, VAL 2, ALA 2, ASP 2, GLY 2, HIS 2, ILE 2, LYS 2, MET 2, THR 2 (residue and the binding sites it lines).

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