Ligand · BHV

BHV · Tert-butyl 4-(2-{3-[3-{[(3-methylbut-2-enoyl) amino]methyl}-4-(trifluoromethyl)phenyl]-1-[3-(morpholin-4-yl)propyl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-oxoethyl)piperidine-1-carboxylate

BHV, Tert-butyl 4-(2-{3-[3-{[(3-methylbut-2-enoyl) amino]methyl}-4-(trifluoromethyl)phenyl]-1-[3-(morpholin-4-yl)propyl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-oxoethyl)piperidine-1-carboxylate (C38 H53 F3 N6 O5, 730.9…

Component: BHV
Formula: C38 H53 F3 N6 O5
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

BHV in 2 structures; the first of them:

5QCB · Crystal structure of human Cathepsin-S with bound ligand · BHV A901 · binds TRP26, TYR61, GLY62, LYS64, ASN67, GLY68, GLY69, PHE70 and 10 more
5QCB · Crystal structure of human cathepsin-S with bound ligand · BHV A901 · binds TRP26, GLY62, ASN67, GLY68, GLY69, PHE70, MET71, THR73 and 7 more

Residues it binds most

GLY 4, ASN 4, PHE 4, VAL 4, HIS 4, MET 4, THR 4, TRP 4, LYS 2, TYR 1 (residue and the binding sites it lines).

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