BDBM50316021 (S)-N-((6S,9S,12S,15S,18S)-1-amino-18-carbamoyl-12-(4-hydroxybenzyl)-1-imino-15-(mercaptomethyl)-21-methyl-7,10,13,16-tetraoxo-9-propyl-2,8,11,14,17-pentaazadocosan-6-yl)-1-((S)-2-amino-5-guanidinopentanoyl)pyrrolidine-2-carboxamide::CHEMBL1090008

SMILES [#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@H](-[#6]-[#16])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](-[#7])=O

InChI Key InChIKey=WHJWQLDBFPVQME-UHFFFAOYSA-N

Data  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 1 hit for monomerid = 50316021   

TargetRAC-alpha serine/threonine-protein kinase(Human)
The Hebrew University of Jerusalem

Curated by ChEMBL
LigandPNGBDBM50316021((S)-N-((6S,9S,12S,15S,18S)-1-amino-18-carbamoyl-12...)
Affinity DataIC50: 400nMAssay Description:Inhibition of PKB by radioactive kinase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/19/2010
Entry Details Article
PubMed