BRENDA - Enzyme Database show

Identification of benzothiophene amides as potent inhibitors of human nicotinamide phosphoribosyltransferase

Chen, W.; Dong, G.; He, S.; Xu, T.; Wang, X.; Liu, N.; Zhang, W.; Miao, C.; Sheng, C.; Bioorg. Med. Chem. Lett. 26, 765-768 (2016)

Data extracted from this reference:

Inhibitors
EC Number
Inhibitors
Commentary
Organism
Structure
2.4.2.12
(2E)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(pyridin-3-yl)prop-2-enamide
-
Homo sapiens
2.4.2.12
(2E)-N-[3-(1H-imidazol-1-yl)propyl]-3-(pyridin-3-yl)prop-2-enamide
-
Homo sapiens
2.4.2.12
CHS828
-
Homo sapiens
2.4.2.12
FK866
-
Homo sapiens
2.4.2.12
GMX1777
-
Homo sapiens
2.4.2.12
N-(2-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-2-oxoethyl)-3-methylthiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-(2-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-2-oxoethyl)-5-methylthiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-benzofuran-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-benzothiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylthiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methylthiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitrothiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[3-(1H-imidazol-1-yl)propyl]-1-benzofuran-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[3-(1H-imidazol-1-yl)propyl]-1-benzothiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[3-(1H-imidazol-1-yl)propyl]-3-methylthiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[3-(1H-imidazol-1-yl)propyl]-5-methylthiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[3-(1H-imidazol-1-yl)propyl]-5-nitrothiophene-2-carboxamide
-
Homo sapiens
Natural Substrates/ Products (Substrates)
EC Number
Natural Substrates
Organism
Commentary (Nat. Sub.)
Natural Products
Commentary (Nat. Pro.)
Organism (Nat. Pro.)
Reversibility
2.4.2.12
nicotinamide + 5-phospho-alpha-D-ribose 1-diphosphate
Homo sapiens
-
nicotinamide D-ribonucleotide + diphosphate
-
-
?
Organism
EC Number
Organism
Primary Accession No. (UniProt)
Commentary
Textmining
2.4.2.12
Homo sapiens
P43490
-
-
Source Tissue
EC Number
Source Tissue
Commentary
Organism
Textmining
2.4.2.12
HCT-116 cell
-
Homo sapiens
-
2.4.2.12
Hep-G2 cell
-
Homo sapiens
-
2.4.2.12
MDA-MB-231 cell
-
Homo sapiens
-
Substrates and Products (Substrate)
EC Number
Substrates
Commentary Substrates
Literature (Substrates)
Organism
Products
Commentary (Products)
Literature (Products)
Organism (Products)
Reversibility
2.4.2.12
nicotinamide + 5-phospho-alpha-D-ribose 1-diphosphate
-
735766
Homo sapiens
nicotinamide D-ribonucleotide + diphosphate
-
-
-
?
IC50 Value
EC Number
IC50 Value
IC50 Value Maximum
Commentary
Organism
Inhibitor
Structure
2.4.2.12
0.00015
-
pH and temperature not specified in the publication
Homo sapiens
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-benzothiophene-2-carboxamide
2.4.2.12
0.00017
-
pH and temperature not specified in the publication
Homo sapiens
N-[3-(1H-imidazol-1-yl)propyl]-5-methylthiophene-2-carboxamide
2.4.2.12
0.00086
-
pH and temperature not specified in the publication
Homo sapiens
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methylthiophene-2-carboxamide
2.4.2.12
0.00095
-
pH and temperature not specified in the publication
Homo sapiens
N-(2-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-2-oxoethyl)-5-methylthiophene-2-carboxamide
2.4.2.12
0.001
-
pH and temperature not specified in the publication
Homo sapiens
N-[3-(1H-imidazol-1-yl)propyl]-1-benzofuran-2-carboxamide
2.4.2.12
0.0011
-
pH and temperature not specified in the publication
Homo sapiens
N-[3-(1H-imidazol-1-yl)propyl]-1-benzothiophene-2-carboxamide
2.4.2.12
0.0014
-
pH and temperature not specified in the publication
Homo sapiens
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-benzofuran-2-carboxamide
2.4.2.12
0.0053
-
pH and temperature not specified in the publication
Homo sapiens
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylthiophene-2-carboxamide
2.4.2.12
0.01
-
pH and temperature not specified in the publication
Homo sapiens
(2E)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(pyridin-3-yl)prop-2-enamide
2.4.2.12
0.01
-
pH and temperature not specified in the publication
Homo sapiens
(2E)-N-[3-(1H-imidazol-1-yl)propyl]-3-(pyridin-3-yl)prop-2-enamide
2.4.2.12
0.01
-
pH and temperature not specified in the publication
Homo sapiens
N-(2-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-2-oxoethyl)-3-methylthiophene-2-carboxamide
2.4.2.12
0.01
-
pH and temperature not specified in the publication
Homo sapiens
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitrothiophene-2-carboxamide
2.4.2.12
0.01
-
pH and temperature not specified in the publication
Homo sapiens
N-[3-(1H-imidazol-1-yl)propyl]-3-methylthiophene-2-carboxamide
2.4.2.12
0.01
-
pH and temperature not specified in the publication
Homo sapiens
N-[3-(1H-imidazol-1-yl)propyl]-5-nitrothiophene-2-carboxamide
IC50 Value (protein specific)
EC Number
IC50 Value
IC50 Value Maximum
Commentary
Organism
Inhibitor
Structure
2.4.2.12
0.00015
-
pH and temperature not specified in the publication
Homo sapiens
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-benzothiophene-2-carboxamide
2.4.2.12
0.00017
-
pH and temperature not specified in the publication
Homo sapiens
N-[3-(1H-imidazol-1-yl)propyl]-5-methylthiophene-2-carboxamide
2.4.2.12
0.00086
-
pH and temperature not specified in the publication
Homo sapiens
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methylthiophene-2-carboxamide
2.4.2.12
0.00095
-
pH and temperature not specified in the publication
Homo sapiens
N-(2-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-2-oxoethyl)-5-methylthiophene-2-carboxamide
2.4.2.12
0.001
-
pH and temperature not specified in the publication
Homo sapiens
N-[3-(1H-imidazol-1-yl)propyl]-1-benzofuran-2-carboxamide
2.4.2.12
0.0011
-
pH and temperature not specified in the publication
Homo sapiens
N-[3-(1H-imidazol-1-yl)propyl]-1-benzothiophene-2-carboxamide
2.4.2.12
0.0014
-
pH and temperature not specified in the publication
Homo sapiens
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-benzofuran-2-carboxamide
2.4.2.12
0.0053
-
pH and temperature not specified in the publication
Homo sapiens
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylthiophene-2-carboxamide
2.4.2.12
0.01
-
pH and temperature not specified in the publication
Homo sapiens
(2E)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(pyridin-3-yl)prop-2-enamide
2.4.2.12
0.01
-
pH and temperature not specified in the publication
Homo sapiens
(2E)-N-[3-(1H-imidazol-1-yl)propyl]-3-(pyridin-3-yl)prop-2-enamide
2.4.2.12
0.01
-
pH and temperature not specified in the publication
Homo sapiens
N-(2-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-2-oxoethyl)-3-methylthiophene-2-carboxamide
2.4.2.12
0.01
-
pH and temperature not specified in the publication
Homo sapiens
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitrothiophene-2-carboxamide
2.4.2.12
0.01
-
pH and temperature not specified in the publication
Homo sapiens
N-[3-(1H-imidazol-1-yl)propyl]-3-methylthiophene-2-carboxamide
2.4.2.12
0.01
-
pH and temperature not specified in the publication
Homo sapiens
N-[3-(1H-imidazol-1-yl)propyl]-5-nitrothiophene-2-carboxamide
Inhibitors (protein specific)
EC Number
Inhibitors
Commentary
Organism
Structure
2.4.2.12
(2E)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(pyridin-3-yl)prop-2-enamide
-
Homo sapiens
2.4.2.12
(2E)-N-[3-(1H-imidazol-1-yl)propyl]-3-(pyridin-3-yl)prop-2-enamide
-
Homo sapiens
2.4.2.12
CHS828
-
Homo sapiens
2.4.2.12
FK866
-
Homo sapiens
2.4.2.12
GMX1777
-
Homo sapiens
2.4.2.12
N-(2-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-2-oxoethyl)-3-methylthiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-(2-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-2-oxoethyl)-5-methylthiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-benzofuran-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-benzothiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylthiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methylthiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitrothiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[3-(1H-imidazol-1-yl)propyl]-1-benzofuran-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[3-(1H-imidazol-1-yl)propyl]-1-benzothiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[3-(1H-imidazol-1-yl)propyl]-3-methylthiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[3-(1H-imidazol-1-yl)propyl]-5-methylthiophene-2-carboxamide
-
Homo sapiens
2.4.2.12
N-[3-(1H-imidazol-1-yl)propyl]-5-nitrothiophene-2-carboxamide
-
Homo sapiens
Natural Substrates/ Products (Substrates) (protein specific)
EC Number
Natural Substrates
Organism
Commentary (Nat. Sub.)
Natural Products
Commentary (Nat. Pro.)
Organism (Nat. Pro.)
Reversibility
2.4.2.12
nicotinamide + 5-phospho-alpha-D-ribose 1-diphosphate
Homo sapiens
-
nicotinamide D-ribonucleotide + diphosphate
-
-
?
Source Tissue (protein specific)
EC Number
Source Tissue
Commentary
Organism
Textmining
2.4.2.12
HCT-116 cell
-
Homo sapiens
-
2.4.2.12
Hep-G2 cell
-
Homo sapiens
-
2.4.2.12
MDA-MB-231 cell
-
Homo sapiens
-
Substrates and Products (Substrate) (protein specific)
EC Number
Substrates
Commentary Substrates
Literature (Substrates)
Organism
Products
Commentary (Products)
Literature (Products)
Organism (Products)
Reversibility
2.4.2.12
nicotinamide + 5-phospho-alpha-D-ribose 1-diphosphate
-
735766
Homo sapiens
nicotinamide D-ribonucleotide + diphosphate
-
-
-
?