Ligand · B4U

B4U · 6-[(2~{S})-2-fluoranylpropyl]-4-[(1-methylcyclopropyl) amino]-2-[[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]amino]pyrido[4,3-d]pyrimidin-5-one

B4U, 6-[(2~{S})-2-fluoranylpropyl]-4-[(1-methylcyclopropyl) amino]-2-[[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]amino]pyrido[4,3-d]pyrimidin-5-one (C23 H31 F N8 O, 454.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component: B4U
Formula: C23 H31 F N8 O
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

B4U in 2 structures; the first of them:

7QG3 · IRAK4 in complex with inhibitor · B4U A501 · binds ILE185, MET192, GLY193, GLU194, VAL200, ALA211, LYS213, GLU233 and 16 more
7QG3 · IRAK4 in complex with inhibitor · B4U A501 · binds ILE185, MET192, GLY193, GLU194, VAL200, ALA211, LYS213, GLU233 and 16 more

Residues it binds most

VAL 4, ASP 4, GLU 4, GLY 4, MET 4, SER 4, TYR 4, ALA 4, ARG 4, ASN 4 (residue and the binding sites it lines).

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