Ligand · 5WF

5WF · 4-[8-azanyl-3-[(3~{R})-1-(3-methyloxetan-3-yl)carbonylpiperidin-3-yl]imidazo[1,5-a]pyrazin-1-yl]-~{N}-[4-(trifluoromethyl)pyridin-2-yl]benzamide

5WF, 4-[8-azanyl-3-[(3~{R})-1-(3-methyloxetan-3-yl)carbonylpiperidin-3-yl]imidazo[1,5-a]pyrazin-1-yl]-~{N}-[4-(trifluoromethyl)pyridin-2-yl]benzamide (C29 H28 F3 N7 O3, 579.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record…

Component: 5WF
Formula: C29 H28 F3 N7 O3
Class: ligand
Structures: 1
PDB entries: 1

Binding sites

5WF in 1 structure; the first of them:

5FBN · BTK kinase domain with inhibitor 1 · 5WF C701 · binds LEU408, GLY409, THR410, GLY411, VAL416, ALA428, LYS430, PHE442 and 18 more

Residues it binds most

LEU 2, GLY 2, MET 2, ALA 2, PHE 2, THR 2, VAL 2, ASN 2, ASP 2, CYS 2 (residue and the binding sites it lines).

Found with

5WE · 4-[8-azanyl-3-[(2~{S})-1-[4-(dimethylamino) butanoyl]pyrrolidin-2-yl]imidazo[1,5-a]pyrazin-1-yl]-~{N}-(1,3-thiazol-2-yl)benzamide
CL · Chloride ion
EDO · 1,2-ethanediol

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