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Ligand · 3NL

3NL · 3-(4-{[(2-chlorophenyl)carbamoyl]amino}-1H-pyrazol-1-yl)-N-{1-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl}benzamide

3NL, 3-(4-{[(2-chlorophenyl)carbamoyl]amino}-1H-pyrazol-1-yl)-N-{1-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl}benzamide (C24 H23 Cl N8 O2, 490.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
3NL
Formula
C24 H23 Cl N8 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

3NL in 2 structures; the first of them:

  • 4WHZ · Design and Synthesis of Highly Potent and Isoform Selective JNK3 Inhibitors: SAR Studies… · 3NL A501 · binds ILE70, VAL78, ASN89, ALA91, ILE92, LYS93, ILE124, LEU126 and 12 more
  • 4WHZ · Design and synthesis of highly potent and isoform selective JNK3 inhibitors: sar studies… · 3NL A501 · binds ILE70, VAL78, ASN89, ALA91, ILE92, LYS93, ILE124, LEU126 and 12 more

Residues it binds most

LEU 2, ILE 2, VAL 2, ALA 2, ASN 2, MET 2, ASP 2, GLN 2, GLU 2, LYS 2 (residue and the binding sites it lines).

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