Ibrutinib

InChIKey XYFPWWZEPKGCCK-GOSISDBHSA-N Formula C25H24N6O2 PubChem CID 24821094 ChEMBL CHEMBL1873475

SMILES C=CC(=O)N1CCC[C@@H](n2nc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)C1

Structure

2D skeletal formula · rendered by chemkit from PubChem 2D coordinates.

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

Protein targets · 1 target

Tyrosine-protein kinase BTK Q06187 · inhibitor · Tyrosine-protein kinase BTK 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.