BDBM50230450 4-carbamoyl-4-(4-carboxy-2-{[(2S,3S)-1-({1-[(2S)-2-(2-{[(2S)-1-[(2S)-4-carboxy-2-{[(2S)-1-{5-[({3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-6-yl}carbamothioyl)amino]pentanoyl}pyrrolidin-2-yl]formamido}butanoyl]pyrrolidin-2-yl]formamido}-3-hydroxybutanamido)propanoyl]piperidin-2-yl}carbonyl)-3-{[(Z)-{[4-(dimethylamino)phenyl]methylidene}amino]oxy}pyrrolidin-2-yl]formamido}butanamido)butanoic acid::CHEMBL402121

SMILES CC(O)C(NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(O)=O)NC(=O)[C@@H]1CCCN1C(=O)CCCCNC(=S)Nc1ccc2C(=O)OC3(c2c1)c1ccc(O)cc1Oc1cc(O)ccc31)C(=O)N[C@@H](C)C(=O)N1CCCCC1C(=O)N1CC[C@H](O\N=C/c2ccc(cc2)N(C)C)[C@H]1C(=O)NC(CCC(O)=O)C(=O)NC(CCC(O)=O)C(N)=O

InChI Key InChIKey=OVNHQNVDWMBWDP-AVHUFWSDSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50230450   

TargetTumor susceptibility gene 101 protein(Homo sapiens (Human))
Nih

Curated by ChEMBL
LigandPNGBDBM50230450(4-carbamoyl-4-(4-carboxy-2-{[(2S,3S)-1-({1-[(2S)-2...)
Affinity DataIC50:  1.20E+4nMAssay Description:Binding affinity to Tsg101More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed