BDBM50346365 20S-(dimethylamino)-16alpha-hydroxy-4beta,14alpha-dimethyl-9,19-cyclo-{2'-(1-fluoro-1-methylethyl)-5',6'-dihydro-4alphaH-[1',3']oxazino[4',5':3,4]}-5alpha,9beta-pregnan-11-one::CHEMBL1783530

SMILES C[C@@H]([C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35C(=O)C[C@]12C)CC[C@@H]1N=C(OC[C@@]41C)C(C)(C)F)N(C)C

InChI Key InChIKey=IIOIREJLGHVBEW-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50346365   

TargetAcetylcholinesterase(Electric eel)
Cnrs

Curated by ChEMBL
LigandPNGBDBM50346365(20S-(dimethylamino)-16alpha-hydroxy-4beta,14alpha-...)
Affinity DataIC50: 336nMAssay Description:Inhibition of Electrophorus electricus AChE using acetylthiocholine iodide as substrate by spectroscopic Ellmans methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/6/2011
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
Cnrs

Curated by ChEMBL
LigandPNGBDBM50346365(20S-(dimethylamino)-16alpha-hydroxy-4beta,14alpha-...)
Affinity DataIC50: 744nMAssay Description:Inhibition of recombinant human AChE using acetylthiocholine iodide as substrate by spectroscopic Ellmans methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/6/2011
Entry Details Article
PubMed
TargetCholinesterase(Human)
Cnrs

Curated by ChEMBL
LigandPNGBDBM50346365(20S-(dimethylamino)-16alpha-hydroxy-4beta,14alpha-...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of recombinant human serum BChE using butyrylthiocholine iodide as substrate by spectroscopic Ellmans methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/6/2011
Entry Details Article
PubMed