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Ligand · YQ2

YQ2 · 2-[[(1~{R})-1-(7-methyl-4-oxidanylidene-2-piperidin-1-yl-3~{H}-pyrido[1,2-a]pyrimidin-9-yl)ethyl]amino]benzoic acid

YQ2, 2-[[(1~{R})-1-(7-methyl-4-oxidanylidene-2-piperidin-1-yl-3~{H}-pyrido[1,2-a]pyrimidin-9-yl)ethyl]amino]benzoic acid (C23 H27 N4 O3 +1, 407.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding…

Component
YQ2
Formula
C23 H27 N4 O3 +1
Class
ligand
Structures
1
PDB entries
1

Binding sites

YQ2 in 1 structure; the first of them:

  • 8V8V · PI3Ka H1047R co-crystal structure with inhibitor in cryptic pocket near H1047R (compound… · YQ2 A1201 · binds CYS901, CYS905, THR908, PHE909, PHE954, THR957, PHE960, LEU961 and 10 more

Residues it binds most

PHE 2, CYS 2, THR 2, MET 2, ALA 2, ARG 2, ASN 2, GLN 2, ILE 2, LEU 2 (residue and the binding sites it lines).

Found with

  • 1LT · (2S)-N~1~-{4-methyl-5-[2-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridin-4-yl]-1,3-thiazol-2-yl}pyrrolidine-1,2-dicarboxamide

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