BDBM50312358 (S)-5-amino-4-(2-((20aS,25aS,31S,34S,36aS,Z)-7-((S)-1-(5-(3-(3',6'-dihydroxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-6-yl)thioureido)pentanoyl)pyrrolidine-2-carbonyl)-34-((R)-1-hydroxyethyl)-31-methyl-5,20,25,30,33,36-hexaoxo-2,3,5,6,7,8,9,10,13,14,15,16,17,18,20a,21,22,23,25a,26,27,28,30,31,32,33,34,35,36,36a-triacontahydrotripyrrolo[2,1-c:2',1'-f:2'',1''-o][1,4,7,10,13,16,19]heptaazacyclotriacontin-19(1H,20H,25H)-yl)acetamido)-5-oxopentanoic acid::CHEMBL1075966

SMILES C[C@@H](O)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)CN(CCCC=CCCCCCCN(CC(=O)N[C@@H](CCC(O)=O)C(N)=O)C(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC1=O)C(=O)[C@@H]1CCCN1C(=O)CCCCNC(=S)Nc1ccc2C(=O)OC3(c2c1)c1ccc(O)cc1Oc1cc(O)ccc31

InChI Key InChIKey=CZSLNDKJXVKYHO-UHFFFAOYSA-N

Data  1 Kd

  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 = 50312358   

TargetTumor susceptibility gene 101 protein(Human)
National Cancer Institute-Frederick

Curated by ChEMBL
LigandPNGBDBM50312358((S)-5-amino-4-(2-((20aS,25aS,31S,34S,36aS,Z)-7-((S...)
Affinity DataKd:  3.00E+4nMAssay Description:Binding affinity to ubiquitin E2 variant domain of human Tsg101 by fluorescent anisotropyMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/17/2010
Entry Details Article
PubMed