BDBM50236754 CHEMBL4082473

SMILES COc1ccc2n(cc(CN3CCN(C)CC3)c2c1)S(=O)(=O)c1ccccc1Br

InChI Key InChIKey=GWCYPEHWIZXYFZ-UHFFFAOYSA-N

Data  4 KI  10 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 14 hits for monomerid = 50236754   

TargetCytochrome P450 3A4(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataIC50: 2.64E+3nMAssay Description:Inhibition of CYP3A4 in human liver microsomes using testosterone as substrate in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
TargetCytochrome P450 2E1(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2E1 in human liver microsomes in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
TargetCytochrome P450 2A6(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2A6 in human liver microsomes in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataIC50: 1.32E+4nMAssay Description:Inhibition of CYP2D6 in human liver microsomes in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataIC50: 5.70E+3nMAssay Description:Inhibition of CYP2C19 in human liver microsomes using mephenytoin as substrate in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2C9 in human liver microsomes in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP1A2 in human liver microsomes in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataIC50: 1.50E+3nMAssay Description:Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
TargetCytochrome P450 2C8(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2C8 in human liver microsomes in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
TargetCytochrome P450 2B6(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2B6 in human liver microsomes in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 6(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataKi:  2nMAssay Description:Displacement of [3H]-LSD from recombinant human 5-HT6 receptor expressed in HEK293 cells after 60 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
TargetD(3) dopamine receptor(Rat)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataKi:  616nMAssay Description:Displacement of [3H] 7-OH DPAT from recombinant rat dopamine D3 receptor expressed in CHO cells after 60 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
TargetAlpha-2C adrenergic receptor(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataKi:  619nMAssay Description:Inhibition of recombinant human adrenergic alpha 2C receptor expressed in CHO cells assessed as inhibition of 5-HT stimulated cAMP accumulation after...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed
TargetAlpha-2A adrenergic receptor(Human)
Suven Life Sciences

Curated by ChEMBL
LigandPNGBDBM50236754(CHEMBL4082473)
Affinity DataKi:  2.57E+3nMAssay Description:Displacement of [3H] MK-912 from human adrenergic alpha 2A receptor expressed in HT29 cells after 60 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/28/2019
Entry Details Article
PubMed