BDBM21003 (2R)-5-[(diaminomethylidene)amino]-2-[(2S)-2-formamido-2-[1-(4-phenylphenyl)acetamido]ethan-1-aminium]-N-[(1S)-2-(4-hydroxyphenyl)-1-[(2-phenylethyl)carbamoyl]ethyl]pentanamide::Tripeptide derivative, 11

SMILES [#7]\[#6](-[#7])=[#7]/[#6]-[#6]-[#6]-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#7+])-[#7]-[#6](=O)-[#6]-c1ccc(cc1)-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6]-[#6]-c1ccccc1

InChI Key InChIKey=QVSQAHNITBRTDK-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 21003   

TargetProcathepsin L(Human)
National Research Council Canada

LigandPNGBDBM21003((2R)-5-[(diaminomethylidene)amino]-2-[(2S)-2-forma...)
Affinity DataKi:  1.07E+4nM ΔG°:  -6.78kcal/molepH: 5.5 T: 2°CAssay Description:Fluorescence was monitored on a SPEX Fluorolog-2 spectrofluorometer with the excitation and emission wavelengths set at 380 and 440 nm, respectively....More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2008
Entry Details Article
PubMed