BDBM9850 (2S)-6-{[(tert-butoxy)carbonyl]amino}-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}hexanoic acid::Lysine derivative 3

SMILES CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc12)C(O)=O

InChI Key InChIKey=UMRUUWFGLGNQLI-UHFFFAOYSA-N

Data  1 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 9850   

TargetCholinesterase(Horse)
California State University

Curated by ChEMBL
LigandPNGBDBM9850((2S)-6-{[(tert-butoxy)carbonyl]amino}-2-{[(9H-fluo...)
Affinity DataIC50: 4.10E+4nMAssay Description:Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate and measured for 60 secs by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/20/2024
Entry Details
PubMed
TargetDimer of Gag-Pol polyprotein [501-599](Human immunodeficiency virus type 1)
Pharmacor

LigandPNGBDBM9850((2S)-6-{[(tert-butoxy)carbonyl]amino}-2-{[(9H-fluo...)
Affinity DataKi:  2.80E+4nM ΔG°:  -6.31kcal/molepH: 4.7 T: 2°CAssay Description:HIV-1 protease activity was measured by a continuous fluorometric assay using the internally quenched fluorogenic substrate DABCYL-Ser-Gln-Asn-Tyr-Pr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/12/2006
Entry Details Article
PubMed