Ligand · 1BS
1BS · 2-{(1S)-1-[(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)amino]-2-phenylethyl}pyrido[4,3-d]pyrimidin-4(1H)-one
1BS, 2-{(1S)-1-[(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)amino]-2-phenylethyl}pyrido[4,3-d]pyrimidin-4(1H)-one (C26 H24 Cl N5 O, 458.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…
- Component
- 1BS
- Formula
- C26 H24 Cl N5 O
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
1BS in 2 structures; the first of them:
- 4I10 · Structure-based design of novel dihydroisoquinoline BACE-1 inhibitors that do not engage… · 1BS A504 · binds GLY72, GLN73, GLY74, LEU91, ASP93, TYR132, GLN134, GLY135 and 12 more
- 4I10 · Structure-based design of novel dihydroisoquinoline bace-1 inhibitors that do not engage… · 1BS A504 · binds GLY72, GLN73, GLY74, LEU91, ASP93, TYR132, GLN134, GLY135 and 12 more
Residues it binds most
GLY 2, ASP 2, GLN 2, LYS 2, THR 2, ARG 2, ASN 2, ILE 2, LEU 2, PHE 2 (residue and the binding sites it lines).
Found with
- ZN · Zinc ion
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