BDBM50082054 (delta23,24-dehydroascomycin)17-Ethyl-1-hydroxy-12-[2-(4-hydroxy-3-methoxy-cyclohexyl)-1-methyl-vinyl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-aza-tricyclo[22.3.1.0*4,9*]octacosa-14,18-diene-2,3,10,16-tetraone::CHEMBL139966

SMILES CCC1=CC(C)C[C@H](C)C[C@H](OC)[C@H]2O[C@](O)([C@H](C)C[C@@H]2OC)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@H](\C(C)=C\[C@@H]2CC[C@@H](O)[C@@H](C2)OC)C(C)=CCC1=O

InChI Key InChIKey=VFWHFORNNWABQJ-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50082054   

TargetPeptidyl-prolyl cis-trans isomerase FKBP1A(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50082054((delta23,24-dehydroascomycin)17-Ethyl-1-hydroxy-12...)
Affinity DataIC50: 529nMAssay Description:The compound was tested for binding affinity against human FK506 binding protein 12More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed