GL1X · GenesisL1 explorer

Ligand · 9CV

9CV · 5-[(4-fluoranyl-3-phenoxy-phenyl)methylamino]-~{N}-methyl-6-[(1-pyridin-2-ylpiperidin-4-yl) amino]pyridine-3-carboxamide

9CV, 5-[(4-fluoranyl-3-phenoxy-phenyl)methylamino]-~{N}-methyl-6-[(1-pyridin-2-ylpiperidin-4-yl) amino]pyridine-3-carboxamide (C30 H31 F N6 O2, 526.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
9CV
Formula
C30 H31 F N6 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

9CV in 2 structures; the first of them:

  • 5G0U · InhA in complex with a DNA encoded library hit · 9CV A302 · binds GLY96, PHE97, MET98, PRO99, GLN100, MET103, GLY104, PHE149 and 7 more
  • 5G0U · Inha in complex with a DNA encoded library hit · 9CV A302 · binds GLY96, PHE97, MET98, PRO99, GLN100, MET103, GLY104, PHE149 and 7 more

Residues it binds most

MET 4, ALA 4, GLY 4, PHE 4, ILE 4, GLN 4, PRO 4, TYR 4, LYS 2 (residue and the binding sites it lines).

Found with

  • NAD · Nicotinamide-adenine-dinucleotide

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.