BDBM50090472 CHEMBL3581703

SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1c[nH]c3ccccc13)NC(=O)[C@@]([H])(NC(=O)[C@]1([H])CSSC[C@]3([H])NC(=O)[C@H](CO)NC(=O)[C@H](CCC(O)=O)NC(=O)CNC(=O)[C@]4([H])CSSC[C@]([H])(NC(=O)CNC(=O)[C@]5([H])CCCN5C(=O)[C@@]([H])(NC(=O)[C@H](CC(N)=O)NC(=O)[C@]([H])(CSSC[C@]([H])(NC(=O)[C@@H](NC2=O)C(C)C)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@]2([H])C(=O)N[C@@]([H])([C@@H](C)CC)C(=O)N4)NC(=O)[C@@]([H])(NC(=O)CNC(=O)CNC(=O)[C@@H](NC3=O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N1)[C@@H](C)O

InChI Key InChIKey=BNBUNKMTKOKOKK-UHFFFAOYSA-N

Data  2 IC50

  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 2 hits for monomerid = 50090472   

TargetProlyl endopeptidase(Human)
Medical University of Vienna

Curated by ChEMBL
LigandPNGBDBM50090472(CHEMBL3581703)
Affinity DataIC50: 9.56E+3nMAssay Description:Inhibition of human recombinant POP pre-incubated for 15 mins before Z-Gly-Pro-AMC substrate addition and further incubated for 1 hr by fluorimetryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/10/2016
Entry Details Article
PubMed
TargetProlyl endopeptidase(Human)
Medical University of Vienna

Curated by ChEMBL
LigandPNGBDBM50090472(CHEMBL3581703)
Affinity DataIC50: 9.56E+3nMAssay Description:Inhibition of human recombinant POP pre-incubated for 15 mins before Z-Gly-Pro-AMC substrate addition and further incubated for 1 hr by fluorimetryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/10/2016
Entry Details Article
PubMed