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Ligand · OQ8

OQ8 · ~{N}-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-[2-[[(3~{S})-1-propanoylpyrrolidin-3-yl]amino]pyrimidin-4-yl]oxy-benzamide

OQ8, ~{N}-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-[2-[[(3~{S})-1-propanoylpyrrolidin-3-yl]amino]pyrimidin-4-yl]oxy-benzamide (C33 H40 F3 N7 O3, 639.7 g/mol), in the MolNFT structures on GenesisL1: bound in…

Component
OQ8
Formula
C33 H40 F3 N7 O3
Class
ligand
Structures
1
PDB entries
1

Binding sites

OQ8 in 1 structure; the first of them:

  • 6YG6 · Crystal structure of MKK7 (MAP2K7) covalently bound with type-II inhibitor TL10-105 · OQ8 A502 · binds MET142, VAL150, ALA163, VAL164, LYS165, ASP182, VAL186, ILE195 and 18 more

Residues it binds most

VAL 2, LEU 2, MET 2, ASP 2, CYS 2, ILE 2, LYS 2, ALA 2, ARG 2, GLU 2 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol

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