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Ligand · QUP

QUP · 1-(5-chloro-2-methylphenyl)-4-(pyrrolo[2,1-f][1,2,4]triazin-4-yl)-1H-pyrrole-2-carboxamide

QUP, 1-(5-chloro-2-methylphenyl)-4-(pyrrolo[2,1-f][1,2,4]triazin-4-yl)-1H-pyrrole-2-carboxamide (C18 H14 Cl N5 O, 351.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
QUP
Formula
C18 H14 Cl N5 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

QUP in 2 structures; the first of them:

  • 5AEP · Novel pyrrole carboxamide inhibitors of JAK2 as potential treatment of myeloproliferative… · QUP A2000 · binds LEU855, GLY856, LYS857, GLY858, GLY861, SER862, VAL863, ALA880 and 11 more
  • 5AEP · Novel pyrrole carboxamide inhibitors of JAK2 as potential treatment of myeloproliferative… · QUP A2000 · binds LEU855, GLY856, LYS857, GLY858, GLY861, SER862, VAL863, ALA880 and 11 more

Residues it binds most

GLY 2, LEU 2, SER 2, VAL 2, ALA 2, ARG 2, ASN 2, ASP 2, GLU 2, LYS 2 (residue and the binding sites it lines).

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