BDBM50433326 CHEMBL2376562

SMILES Cc1ccc(cc1)S(=O)(=O)Nc2cc(ccc2C(=O)O)Oc3ccccc3

InChI Key InChIKey=JLEWSFZFGVKGLO-UHFFFAOYSA-N

Data  4 IC50

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50433326   

TargetCytochrome P450 2D6(Human)
Boehringer Ingelheim (Canada)

Curated by ChEMBL
LigandPNGBDBM50433326(CHEMBL2376562)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of CYP2D6 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2014
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Boehringer Ingelheim (Canada)

Curated by ChEMBL
LigandPNGBDBM50433326(CHEMBL2376562)
Affinity DataIC50: 7.90E+3nMAssay Description:Inhibition of CYP2C19 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2014
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Boehringer Ingelheim (Canada)

Curated by ChEMBL
LigandPNGBDBM50433326(CHEMBL2376562)
Affinity DataIC50: 3.10E+3nMAssay Description:Inhibition of CYP2C9 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2014
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Boehringer Ingelheim (Canada)

Curated by ChEMBL
LigandPNGBDBM50433326(CHEMBL2376562)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of CYP1A2 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2014
Entry Details Article
PubMed