BDBM50158911 CHEMBL179529::Methyl-(5-pyridin-3-yl-thiophen-2-yl)-amine

SMILES CNc1ccc(s1)-c1cccnc1

InChI Key InChIKey=OUEHWWLIEPNPDR-UHFFFAOYSA-N

Data  1 KI  7 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50158911   

TargetCytochrome P450 2A6(Homo sapiens (Human))
Human Biomolecular Research Institute

Curated by ChEMBL
LigandPNGBDBM50158911(CHEMBL179529 | Methyl-(5-pyridin-3-yl-thiophen-2-y...)
Affinity DataKi:  590nMAssay Description:Effect on coumarin 7-hydroxylation by human Cytochrome P-450 2A6More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2E1(Homo sapiens (Human))
Human Biomolecular Research Institute

Curated by ChEMBL
LigandPNGBDBM50158911(CHEMBL179529 | Methyl-(5-pyridin-3-yl-thiophen-2-y...)
Affinity DataIC50:  3.11E+4nMAssay Description:Inhibitory concentration value against human cytochrome P-450 2E1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2D6(Homo sapiens (Human))
Human Biomolecular Research Institute

Curated by ChEMBL
LigandPNGBDBM50158911(CHEMBL179529 | Methyl-(5-pyridin-3-yl-thiophen-2-y...)
Affinity DataIC50:  1.44E+4nMAssay Description:Inhibitory concentration value against human cytochrome P-450 2D6More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C19(Homo sapiens (Human))
Human Biomolecular Research Institute

Curated by ChEMBL
LigandPNGBDBM50158911(CHEMBL179529 | Methyl-(5-pyridin-3-yl-thiophen-2-y...)
Affinity DataIC50:  3.20E+3nMAssay Description:Inhibitory concentration value against human cytochrome P-450 2C19More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C9(Homo sapiens (Human))
Human Biomolecular Research Institute

Curated by ChEMBL
LigandPNGBDBM50158911(CHEMBL179529 | Methyl-(5-pyridin-3-yl-thiophen-2-y...)
Affinity DataIC50:  2.10E+3nMAssay Description:Inhibitory concentration against human cytochrome P-450 2C9More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2B6(Homo sapiens (Human))
Human Biomolecular Research Institute

Curated by ChEMBL
LigandPNGBDBM50158911(CHEMBL179529 | Methyl-(5-pyridin-3-yl-thiophen-2-y...)
Affinity DataIC50:  6.80E+3nMAssay Description:Inhibitory concentration value against human cytochrome P-450 2B6More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2A6(Homo sapiens (Human))
Human Biomolecular Research Institute

Curated by ChEMBL
LigandPNGBDBM50158911(CHEMBL179529 | Methyl-(5-pyridin-3-yl-thiophen-2-y...)
Affinity DataIC50:  3.50E+3nMAssay Description:Inhibitory concentration value against human cytochrome P-450 2A6More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
Human Biomolecular Research Institute

Curated by ChEMBL
LigandPNGBDBM50158911(CHEMBL179529 | Methyl-(5-pyridin-3-yl-thiophen-2-y...)
Affinity DataIC50:  6.30E+3nMAssay Description:Inhibitory concentration value against human cytochrome P-450 3A4More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed