Ligand · I9H
I9H · N-[3-(4-chlorophenyl)-1-{N'-cyano-N-[3-(difluoromethoxy)phenyl]carbamimidoyl}-4,5-dihydro-1H- pyrazol-4-yl]-N-ethyl-2-hydroxyacetamide
I9H, N-[3-(4-chlorophenyl)-1-{N'-cyano-N-[3-(difluoromethoxy)phenyl]carbamimidoyl}-4,5-dihydro-1H- pyrazol-4-yl]-N-ethyl-2-hydroxyacetamide (C22 H21 Cl F2 N6 O3, 490.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…
- Component
- I9H
- Formula
- C22 H21 Cl F2 N6 O3
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
I9H in 2 structures; the first of them:
- 5ARF · SMYD2 in complex with small molecule inhibitor compound-2 · I9H A1001 · binds GLU104, THR105, LEU108, VAL179, ASN180, ASN182, GLY183, PHE184 and 12 more
- 5ARF · SMYD2 in complex with small molecule inhibitor compound-2 · I9H A1001 · binds GLU104, THR105, LEU108, VAL179, ASN180, ASN182, GLY183, PHE184 and 12 more
Residues it binds most
THR 2, TYR 2, ASN 2, GLU 2, SER 2, VAL 2, ALA 2, GLY 2, ILE 2, LEU 2 (residue and the binding sites it lines).
Found with
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