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Ligand · J7J

J7J · N-(5-amino-2-chloropyridin-4-yl)-N'-(4-bromo-3-{[3-(hydroxymethyl)phenyl]ethynyl}-1,2-thiazol-5-yl)urea

J7J, N-(5-amino-2-chloropyridin-4-yl)-N'-(4-bromo-3-{[3-(hydroxymethyl)phenyl]ethynyl}-1,2-thiazol-5-yl)urea (C18 H13 Br Cl N5 O2 S, 478.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
J7J
Formula
C18 H13 Br Cl N5 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

J7J in 2 structures; the first of them:

  • 6EG2 · Crystal structure of human BRM in complex with compound 16 · J7J A1001 · binds ILE779, TYR830, ILE833, ILE834, VAL850, GLU852, HIS859, LEU863 and 14 more
  • 6EG2 · Crystal structure of human brm in complex with compound 16 · J7J A1001 · binds ILE833, ILE834, VAL850, GLU852, HIS859, LEU863, THR864, LEU878 and 11 more

Residues it binds most

LEU 2, THR 2, ILE 2, GLU 2, ALA 2, GLN 2, HIS 2, LYS 2, PHE 2, PRO 2 (residue and the binding sites it lines).

Found with

  • IPA · Isopropyl alcohol

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