BDBM50123742 CHEMBL412946::Cyclosporin A analogue

SMILES CC[C@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C(=O)OCSC)N(C)C(=O)[C@@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C

InChI Key InChIKey=GXTOWQBJSRKFNT-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 = 50123742   

TargetProtein phosphatase 3 catalytic subunit alpha(Human)
Enanta Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50123742(Cyclosporin A analogue | CHEMBL412946)
Affinity DataIC50: 348nMAssay Description:Compound was evaluated for its inhibitory activity in a calcineurin inhibition assay (morn)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetProtein phosphatase 3 catalytic subunit alpha(Human)
Enanta Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50123742(Cyclosporin A analogue | CHEMBL412946)
Affinity DataIC50: 2.15E+3nMAssay Description:Compound was evaluated for its inhibitory activity in a calcineurin inhibition assay (MTM)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed