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BDBM50221195 8a-benzyl-2-(biphenyl-4-sulfonyl)-1,3,4,7,8,8a-hexahydro-2H-isoquinolin-6-one::CHEMBL247235

SMILES: O=C1CCC2(Cc3ccccc3)CN(CCC2=C1)S(=O)(=O)c1ccc(cc1)-c1ccccc1

InChI Key: InChIKey=ULSWLLCHBONCEP-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50221195   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50221195
PNG
(8a-benzyl-2-(biphenyl-4-sulfonyl)-1,3,4,7,8,8a-hex...)
Show SMILES O=C1CCC2(Cc3ccccc3)CN(CCC2=C1)S(=O)(=O)c1ccc(cc1)-c1ccccc1 |c:18|
Show InChI InChI=1S/C28H27NO3S/c30-26-15-17-28(20-22-7-3-1-4-8-22)21-29(18-16-25(28)19-26)33(31,32)27-13-11-24(12-14-27)23-9-5-2-6-10-23/h1-14,19H,15-18,20-21H2
PDB

KEGG

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Patents


Similars

Article
PubMed
55n/an/an/an/an/an/an/an/a



Corcept Therapeutics

Curated by ChEMBL


Assay Description
Displacement of [3H]dexamethasone from human glucocorticoid receptor expressed in recombinant baculovirus


Bioorg Med Chem Lett 17: 5704-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.055
BindingDB Entry DOI: 10.7270/Q2FX7B8B
More data for this
Ligand-Target Pair