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Ligand · QFN

QFN · (4~{R})-4-(4-chlorophenyl)-1-cyclopropyl-5-(1,5-dimethyl-6-oxidanylidene-pyridin-3-yl)-3-methyl-4~{H}-pyrrolo[3,4-c]pyrazol-6-one

QFN, (4~{R})-4-(4-chlorophenyl)-1-cyclopropyl-5-(1,5-dimethyl-6-oxidanylidene-pyridin-3-yl)-3-methyl-4~{H}-pyrrolo[3,4-c]pyrazol-6-one (C22 H21 Cl N4 O2, 408.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
QFN
Formula
C22 H21 Cl N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

QFN in 2 structures; the first of them:

  • 6ZCI · Crystal structure of BRD4-BD1 in complex with NVS-BET-1 · QFN A201 · binds TRP81, PRO82, PHE83, GLN85, VAL87, LYS91, LEU92, LEU94 and 7 more
  • 6ZCI · Crystal structure of BRD4-BD1 in complex with nvs-bet-1 · QFN A201 · binds TRP81, PRO82, PHE83, GLN85, VAL87, LEU92, TYR139, ASN140 and 3 more

Residues it binds most

LEU 2, TYR 2, ASN 2, ASP 2, GLN 2, ILE 2, MET 2, PHE 2, PRO 2, TRP 2 (residue and the binding sites it lines).

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