BDBM50040787 CHEMBL3137809::Sodium salt of 4,5,8-trisulphuricacid-10,13-Dimethyl-17-(1,4,5,5-tetramethyl-hexyl)-hexadecahydro-cyclopenta[a]phenanthrene

SMILES [H][C@@]12CCC(C(C)CCC(C)C(C)(C)C)C1(C)CC[C@@]1([H])[C@@]2([H])C[C@H](OS([O-])(=O)=O)C2C[C@H](OS([O-])(=O)=O)[C@H](CC12C)OS([O-])(=O)=O

InChI Key InChIKey=UYXOPBYFUWYADH-UHFFFAOYSA-K

Data  1 IC50  2 Kd

  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 = 50040787   

TargetAdenosine receptor A1(Rat)
TBA

Curated by ChEMBL
LigandPNGBDBM50040787(Sodium salt of 4,5,8-trisulphuricacid-10,13-Dimeth...)
Affinity DataIC50: 1.20E+5nMAssay Description:Kd value for adenosine A1 receptor binding at 14.5 uMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/17/2010
Entry Details Article

TargetAdenosine receptor A1(Rat)
TBA

Curated by ChEMBL
LigandPNGBDBM50040787(Sodium salt of 4,5,8-trisulphuricacid-10,13-Dimeth...)
Affinity DataKd:  11nMAssay Description:Kd value for adenosine A1 receptor binding at 145 uMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/17/2010
Entry Details Article

TargetAdenosine receptor A1(Rat)
TBA

Curated by ChEMBL
LigandPNGBDBM50040787(Sodium salt of 4,5,8-trisulphuricacid-10,13-Dimeth...)
Affinity DataKd:  1.40nMAssay Description:Kd value for adenosine A1 receptor binding at 14.5 uMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/17/2010
Entry Details Article