BDBM50336728 4-(3-Methyl-butyrylamino)-N-thiazol-2-yl-benzamide::CHEMBL1671921

SMILES CC(C)CC(=O)Nc1ccc(cc1)C(=O)Nc1nccs1

InChI Key InChIKey=NRYURYQHEDZXCQ-UHFFFAOYSA-N

Data  2 KI  5 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 7 hits for monomerid = 50336728   

TargetAdenosine receptor A2a(Homo sapiens (Human))
H. Lundbeck

Curated by ChEMBL
LigandPNGBDBM50336728(4-(3-Methyl-butyrylamino)-N-thiazol-2-yl-benzamide...)
Affinity DataKi:  59nMAssay Description:Antagonist activity at human adenosine A2A receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
H. Lundbeck

Curated by ChEMBL
LigandPNGBDBM50336728(4-(3-Methyl-butyrylamino)-N-thiazol-2-yl-benzamide...)
Affinity DataKi:  90nMAssay Description:Displacement of [3H]-ZM241385 from human adenosine A2A receptor expressed in high five cells after 30 mins by scintillation countingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C19(Homo sapiens (Human))
H. Lundbeck

Curated by ChEMBL
LigandPNGBDBM50336728(4-(3-Methyl-butyrylamino)-N-thiazol-2-yl-benzamide...)
Affinity DataIC50: >4.00E+4nMAssay Description:Inhibition of recombinant CYP2C19 after 45 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C9(Homo sapiens (Human))
H. Lundbeck

Curated by ChEMBL
LigandPNGBDBM50336728(4-(3-Methyl-butyrylamino)-N-thiazol-2-yl-benzamide...)
Affinity DataIC50: >4.00E+4nMAssay Description:Inhibition of recombinant CYP2C9 after 45 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 1A2(Homo sapiens (Human))
H. Lundbeck

Curated by ChEMBL
LigandPNGBDBM50336728(4-(3-Methyl-butyrylamino)-N-thiazol-2-yl-benzamide...)
Affinity DataIC50: >4.00E+4nMAssay Description:Inhibition of recombinant CYP1A2 after 28 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
H. Lundbeck

Curated by ChEMBL
LigandPNGBDBM50336728(4-(3-Methyl-butyrylamino)-N-thiazol-2-yl-benzamide...)
Affinity DataIC50: >4.00E+4nMAssay Description:Inhibition of recombinant CYP3A4 after 30 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2D6(Homo sapiens (Human))
H. Lundbeck

Curated by ChEMBL
LigandPNGBDBM50336728(4-(3-Methyl-butyrylamino)-N-thiazol-2-yl-benzamide...)
Affinity DataIC50: >4.00E+4nMAssay Description:Inhibition of recombinant CYP2D6 after 45 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed