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SMILES c1[nH]nnc1-c1ccccc1

InChI Key InChIKey=LUEYUHCBBXWTQT-UHFFFAOYSA-N

PDB links: 2 PDB IDs contain this monomer as substructures. 3 PDB IDs contain inhibitors having a similarity of 90% to this monomer.

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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 13 hits for monomerid = 17448   

TargetMethionine aminopeptidase 2(Homo sapiens (Human))
GSK

LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataKi:  70nM ΔG°:  -9.66kcal/molepH: 7.5 T: 2°CAssay Description:MetAP2 activity was monitored by measuring the initial velocity of turnover of the artificial substrate Met-AMC. Assays were performed in 96-well mi...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q26M3537PubMed
TargetIndoleamine 2,3-dioxygenase 1(Homo sapiens (Human))
Fudan University

Curated by ChEMBL
LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataKi:  2.25E+4nMAssay Description:Uncompetitive inhibition of human recombinant indoleamine-2,3-dioxygenase expressed in Escherichia coli BL21 using L-tryptophan as substrate by Dixon...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2KH0NRSPubMed
TargetTryptophan 2,3-dioxygenase(Mus musculus)
Institute for Cancer Research

Curated by ChEMBL
LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataIC50: 4.00E+5nMAssay Description:Inhibition of mouse recombinant TDO expressed in mouse P815B cells assessed as blockade of tryptophan degradation by HPLCMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2BC40G9PubMed
TargetIndoleamine 2,3-dioxygenase 1(Homo sapiens (Human))
Fudan University

Curated by ChEMBL
LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataIC50: 6.00E+4nMAssay Description:Inhibition of human recombinant IDO expressed in Escherichia coli BL21 AIMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2BC40G9PubMed
TargetIndoleamine 2,3-dioxygenase 1(Homo sapiens (Human))
Fudan University

Curated by ChEMBL
LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataIC50: 8.30E+4nMpH: 6.5Assay Description:Inhibition of human recombinant N-terminal His-tagged IDO1 (Ala2 to Gly403) overexpressed in Escherichia coli BL21 at pH 6.5 after 60 mins by HPLC an...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q27H1KNWPubMed
TargetIndoleamine 2,3-dioxygenase 1(Homo sapiens (Human))
Fudan University

Curated by ChEMBL
LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataIC50: 7.00E+4nMAssay Description:Inhibition of human recombinant IDO expressed in HEK293 cells assessed as blockade of tryptophan degradation by HPLCMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2BC40G9PubMed
TargetIndoleamine 2,3-dioxygenase 1(Homo sapiens (Human))
Fudan University

Curated by ChEMBL
LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataIC50: 8.90E+3nMAssay Description:Inhibition of human IDO1 transfected in mouse P815B clone-6 cells by HPLC analysisMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q27H1KNWPubMed
TargetIndoleamine 2,3-dioxygenase 1(Mus musculus)
Ludwig Center for Cancer Research of the University of Lausanne

Curated by ChEMBL
LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataIC50: 180nMAssay Description:Inhibition of mouse IDO1 in P815 clone 6 cells by HPLC analysisMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q27H1KNWPubMed
TargetTryptophan 2,3-dioxygenase(Mus musculus)
Institute for Cancer Research

Curated by ChEMBL
LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of mouse TDO in P815 clone 12 cells by HPLC analysisMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q27H1KNWPubMed
TargetTryptophan 2,3-dioxygenase(Homo sapiens (Human))
Ludwig Center for Cancer Research of the University of Lausanne

Curated by ChEMBL
LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human TDO transfected in mouse P815B clone 19 cells by HPLC analysisMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q27H1KNWPubMed
TargetIndoleamine 2,3-dioxygenase 1(Homo sapiens (Human))
Fudan University

Curated by ChEMBL
LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataIC50: 2.51E+5nMAssay Description:Inhibition of indoleamine-2,3-dioxygenase in human HEK293 cells assessed as N-formylkynurenine level after 5 hrs by spectrophotometric analysisMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2KH0NRSPubMed
TargetIndoleamine 2,3-dioxygenase 1(Homo sapiens (Human))
Fudan University

Curated by ChEMBL
LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataIC50: 1.43E+5nMAssay Description:Inhibition of human recombinant indoleamine-2,3-dioxygenase expressed in Escherichia coli BL21 using L-tryptophan as substrate after 30 mins by micro...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2KH0NRSPubMed
TargetIndoleamine 2,3-dioxygenase 1(Mus musculus)
Ludwig Center for Cancer Research of the University of Lausanne

Curated by ChEMBL
LigandPNGBDBM17448(1,2,3-triazole analogue, 4 | 5-phenyl-1H-1,2,3-tri...)copy SMILEScopy InChI
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of mouse recombinant IDO expressed in mouse P815B cells assessed as blockade of tryptophan degradation by HPLCMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2BC40G9PubMed