GL1X · GenesisL1 explorer

Ligand · YIS

YIS · 1-[3-tert-butyl-1-(3-chloro-4-hydroxyphenyl)-1H-pyrazol-5-yl]-3-{2-[(3-{2-[(2-hydroxyethyl)sulfanyl]phenyl}[1,2,4]triazolo[4,3-a]pyridin-6-yl)sulfanyl]benzyl}urea

YIS, 1-[3-tert-butyl-1-(3-chloro-4-hydroxyphenyl)-1H-pyrazol-5-yl]-3-{2-[(3-{2-[(2-hydroxyethyl)sulfanyl]phenyl}[1,2,4]triazolo[4,3-a]pyridin-6-yl)sulfanyl]benzyl}urea (C35 H34 Cl N7 O3 S2, 700.3 g/mol), in the MolNFT structures on…

Component
YIS
Formula
C35 H34 Cl N7 O3 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

YIS in 2 structures; the first of them:

  • 2YIS · triazolopyridine inhibitors of p38 kinase. · YIS A1353 · binds VAL30, VAL38, ALA51, VAL52, LYS53, ARG67, ARG70, GLU71 and 21 more
  • 2YIS · Triazolopyridine inhibitors of P38 kinase. · YIS A1353 · binds VAL30, VAL38, ALA51, VAL52, LYS53, ARG67, ARG70, GLU71 and 21 more

Residues it binds most

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

Found with

  • I46 · 2-fluoro-4-[4-(4-fluorophenyl)-1H-pyrazol-3-yl]pyridine

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