lmmol · Compounds

Petesicatib

InChIKey KXAAIORSMACJSI-AEFFLSMTSA-N Formula C25H23F6N5O4S PubChem CID 59543597 ChEMBL CHEMBL4297638

SMILES Cn1cc(-c2ccc(S(=O)(=O)[C@@H]3C[C@@H](C(=O)NC4(C#N)CC4)N(C(=O)C4(C(F)(F)F)CC4)C3)c(C(F)(F)F)c2)cn1

Structure

Pseudo-3D ball-and-stick · chemkit, from PubChem 3D conformer coordinates.

Protein targets · 1 target

  • Cathepsin S P25774 · inhibitor · Cathepsin S inhibitor

Each resolved target links to its lmmol protein document; action and mechanism are from the bioactivity record.

A document in the lmmol reference corpus — a real compound (PubChem / ChEMBL identity, chemkit-rendered structure) cross-linked to the protein documents it targets. Hover any link to preview its target.