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NIH3D

Ibrutinib

PubChem 24821094
was used by NIH 3D workflows to automatically generate models for
Robert Britton
Created:
11/23/17
Submitted:
3/6/23
Published:
3/6/23

Select an image below to view

3DPX-008346

Licensing:

Public Domain
82
2
Version 2

Category

Small Molecules
Small Molecules
Description

Ibrutinib is a member of the class of acrylamides that is (3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidine in which the piperidine nitrogen is replaced by an acryloyl group. A selective and covalent inhibitor of the enzyme Bruton's tyrosine kinase, it is used for treatment of B-cell malignancies. It has a role as an EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor and an antineoplastic agent. It is a pyrazolopyrimidine, an aromatic amine, an aromatic ether, a member of acrylamides, a N-acylpiperidine and a tertiary carboxamide.
https://pubchem.ncbi.nlm.nih.gov/image/imagefly.cgi?cid=24821094&width=400&height=400
https://pubchem.ncbi.nlm.nih.gov/image/imagefly.cgi?cid=24821094&width=400&height=400