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Ligand · 8C1

8C1 · 4-{[(3R)-piperidin-3-yl]oxy}-6-[(propan-2-yl) oxy]quinoline-7-carboxamide

8C1, 4-{[(3R)-piperidin-3-yl]oxy}-6-[(propan-2-yl) oxy]quinoline-7-carboxamide (C18 H23 N3 O3, 329.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
8C1
Formula
C18 H23 N3 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

8C1 in 2 structures; the first of them:

  • 5UIS · Crystal structure of IRAK4 in complex with compound 12 · 8C1 A800 · binds MET192, GLY193, GLU194, GLY195, VAL200, ALA211, LYS213, VAL246 and 12 more
  • 5UIS · Crystal structure of IRAK4 in complex with compound 12 · 8C1 A800 · binds MET192, GLU194, GLY195, VAL200, ALA211, VAL246, TYR262, VAL263 and 9 more

Residues it binds most

VAL 8, GLY 8, ALA 8, TYR 8, MET 8, SER 8, ASP 5, ASN 8, GLU 8, LEU 8 (residue and the binding sites it lines).

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