Compile Data Set for Download or QSAR
Found 102 with Last Name = 'bagnati' and Initial = 'r'
LigandPNGBDBM50281169(CHEMBL4173846 | US20240034730, Compound 1)copy SMILEScopy InChI
Affinity DataIC50: 1.20nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
LigandPNGBDBM50586377(CHEMBL5086254 | US20240034730, Compound 7)copy SMILES
Affinity DataIC50: 1.40nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM15339(6-fluoro-2-[4-(2-fluorophenyl)phenyl]-3-methyl-qui...)copy SMILEScopy InChI
Affinity DataIC50: 1.80nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
LigandPNGBDBM50586381(CHEMBL5092556 | US20240034730, Compound 11)copy SMILES
Affinity DataIC50: 2nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM50586385(CHEMBL5090431 | US20240034730, Compound 15)copy SMILES
Affinity DataIC50: 2.30nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM50586386(CHEMBL5084878 | US20240034730, Compound 16)copy SMILES
Affinity DataIC50: 2.80nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM50586384(CHEMBL5088148 | US20240034730, Compound 14)copy SMILES
Affinity DataIC50: 2.80nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM50586374(CHEMBL5075870 | US20240034730, Compound 4)copy SMILES
Affinity DataIC50: 3.40nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM50586387(CHEMBL5090281 | US20240034730, Compound 17)copy SMILES
Affinity DataIC50: 4.10nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM50281170(CHEMBL4165923 | US20240034730, Compound 2)copy SMILEScopy InChI
Affinity DataIC50: 4.30nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM50586375(CHEMBL5087682 | US20240034730, Compound 5)copy SMILES
Affinity DataIC50: 5.80nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM470454(N-(2-chloro-6-fluorophenyl)-4-[4-ethyl-3-(hydroxym...)copy SMILEScopy InChI
Affinity DataIC50: 6nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
LigandPNGBDBM50586378(CHEMBL5079607 | US20240034730, Compound 8)copy SMILES
Affinity DataIC50: 6.20nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM50586383(CHEMBL5078949 | US20240034730, Compound 13)copy SMILES
Affinity DataIC50: 6.30nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM50586380(CHEMBL5071607 | US20240034730, Compound 10)copy SMILES
Affinity DataIC50: 18nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM119812(US20240034730, Compound ASLAN003 | US8691852, 20)copy SMILEScopy InChI
Affinity DataIC50: 35nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM50281171(CHEMBL4177202 | US20240034730, Compound 3)copy SMILEScopy InChI
Affinity DataIC50: 35nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
TargetDihydroorotate dehydrogenase (quinone), mitochondrial(Plasmodium falciparum (isolate 3D7))
University of Turin

Curated by ChEMBL
LigandPNGBDBM24400(5-methyl-N-(naphthalen-2-yl)-[1,2,4]triazolo[1,5-a...)copy SMILEScopy InChI
Affinity DataIC50: 65nMAssay Description:Inhibition of Plasmodium falciparum recombinant N-terminal His6-tagged DHODH (159-569 residues) expressed in Escherichia coli BL21(DE3) using DHO as ...More data for this Ligand-Target Pair
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50593724(CHEMBL5194388)copy SMILES
Affinity DataIC50: 69nMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TB1BWPPubMed
LigandPNGBDBM50586382(CHEMBL5079952 | US20240034730, Compound 12)copy SMILES
Affinity DataIC50: 72nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
LigandPNGBDBM50586376(CHEMBL5090397 | US20240034730, Compound 6)copy SMILES
Affinity DataIC50: 91nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
TargetProstaglandin G/H synthase 1(Ovis aries (Sheep))
University of Turin

Curated by ChEMBL
LigandPNGBDBM17638(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)copy SMILEScopy InChI
Affinity DataIC50: 100nMAssay Description:Inhibition of ovine COX1 assessed as reduction in PGF2alpha production by ELISAMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2HT2SPSPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50593730(CHEMBL5172658)copy SMILES
Affinity DataIC50: 110nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TB1BWPPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50509767(CHEMBL4513510)copy SMILEScopy InChI
Affinity DataIC50: 120nMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TB1BWPPubMed
LigandPNGBDBM50586379(CHEMBL5080170 | US20240034730, Compound 9)copy SMILES
Affinity DataIC50: 150nMAssay Description:Inhibition of human recombinant N-terminal GST-tagged DHODH expressed in Escherichia coli BL21(DE3) using dihydroorotate substrate preincubated for 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G164QNPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50462392(CHEMBL4248154)copy SMILEScopy InChI
Affinity DataIC50: 190nMAssay Description:Inhibition of recombinant N-terminal GST-tagged human AKR1C3 expressed in Escherichia coli BL21 (DE) Codon Plus RP cells using S-tetralol as substrat...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S46VMTPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50593732(CHEMBL5174744)copy SMILES
Affinity DataIC50: 190nMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TB1BWPPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50593726(CHEMBL5204156)copy SMILES
Affinity DataIC50: 210nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TB1BWPPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50593727(CHEMBL5170149)copy SMILES
Affinity DataIC50: 220nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TB1BWPPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50462395(CHEMBL4238437)copy SMILEScopy InChI
Affinity DataIC50: 260nMAssay Description:Inhibition of recombinant N-terminal GST-tagged human AKR1C3 expressed in Escherichia coli BL21 (DE) Codon Plus RP cells using S-tetralol as substrat...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S46VMTPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50593728(CHEMBL5170401)copy SMILES
Affinity DataIC50: 260nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TB1BWPPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50593729(CHEMBL5175151)copy SMILES
Affinity DataIC50: 270nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TB1BWPPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50509974(CHEMBL4434843)copy SMILEScopy InChI
Affinity DataIC50: 300nMAssay Description:Inhibition of N-terminal GST-tagged recombinant human AKR1C3 His5Gln mutant expressed in Escherichia coli BL21 (DE) Codon Plus RP cells assessed as r...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2HT2SPSPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50277998(CHEMBL4174786)copy SMILEScopy InChI
Affinity DataIC50: 310nMAssay Description:Inhibition of recombinant N-terminal GST-tagged human AKR1C3 expressed in Escherichia coli BL21 (DE) Codon Plus RP cells using S-tetralol as substrat...More data for this Ligand-Target Pair
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50593725(CHEMBL5206583)copy SMILES
Affinity DataIC50: 310nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TB1BWPPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50462394(CHEMBL4249650)copy SMILEScopy InChI
Affinity DataIC50: 310nMAssay Description:Inhibition of recombinant N-terminal GST-tagged human AKR1C3 expressed in Escherichia coli BL21 (DE) Codon Plus RP cells using S-tetralol as substrat...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S46VMTPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50593722(CHEMBL5191752)copy SMILES
Affinity DataIC50: 400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TB1BWPPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50462391(CHEMBL4238142)copy SMILEScopy InChI
Affinity DataIC50: 400nMAssay Description:Inhibition of recombinant N-terminal GST-tagged human AKR1C3 expressed in Escherichia coli BL21 (DE) Codon Plus RP cells using S-tetralol as substrat...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S46VMTPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM17636(2-{[3-(trifluoromethyl)phenyl]amino}benzoic acid |...)copy SMILEScopy InChI
Affinity DataIC50: 440nMAssay Description:Inhibition of recombinant N-terminal GST-tagged human AKR1C3 expressed in Escherichia coli BL21 (DE) Codon Plus RP cells using S-tetralol as substrat...More data for this Ligand-Target Pair
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50593723(CHEMBL5187723)copy SMILES
Affinity DataIC50: 470nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TB1BWPPubMed
TargetAldo-keto reductase family 1 member C2(Homo sapiens (Human))
University of Torino

Curated by ChEMBL
LigandPNGBDBM17636(2-{[3-(trifluoromethyl)phenyl]amino}benzoic acid |...)copy SMILEScopy InChI
Affinity DataIC50: 530nMAssay Description:Inhibition of recombinant N-terminal GST-tagged human AKR1C2 expressed in Escherichia coli BL21 (DE) Codon Plus RP cells using S-tetralol as substrat...More data for this Ligand-Target Pair
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50462397(CHEMBL4245231)copy SMILEScopy InChI
Affinity DataIC50: 550nMAssay Description:Inhibition of recombinant N-terminal GST-tagged human AKR1C3 expressed in Escherichia coli BL21 (DE) Codon Plus RP cells using S-tetralol as substrat...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S46VMTPubMed
TargetProstaglandin G/H synthase 2(Homo sapiens (Human))
University of Turin

Curated by ChEMBL
LigandPNGBDBM17638(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)copy SMILEScopy InChI
Affinity DataIC50: 610nMAssay Description:Inhibition of human COX2 assessed as reduction in PGF2alpha production by ELISAMore data for this Ligand-Target Pair
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50509973(CHEMBL4590005)copy SMILEScopy InChI
Affinity DataIC50: 940nMAssay Description:Inhibition of N-terminal GST-tagged recombinant human AKR1C3 His5Gln mutant expressed in Escherichia coli BL21 (DE) Codon Plus RP cells assessed as r...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2HT2SPSPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50462393(CHEMBL4249427)copy SMILEScopy InChI
Affinity DataIC50: 1.41E+3nMAssay Description:Inhibition of recombinant N-terminal GST-tagged human AKR1C3 expressed in Escherichia coli BL21 (DE) Codon Plus RP cells using S-tetralol as substrat...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S46VMTPubMed
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50593731(CHEMBL5183881)copy SMILES
Affinity DataIC50: 1.63E+3nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TB1BWPPubMed
TargetDihydroorotate dehydrogenase (quinone), mitochondrial(Plasmodium falciparum (isolate 3D7))
University of Turin

Curated by ChEMBL
LigandPNGBDBM50507739(CHEMBL4458056)copy SMILEScopy InChI
Affinity DataIC50: 2.80E+3nMAssay Description:Inhibition of Plasmodium falciparum recombinant N-terminal His6-tagged DHODH (159-569 residues) expressed in Escherichia coli BL21(DE3) using DHO as ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))TBA
LigandPNGBDBM50462396(CHEMBL4238730)copy SMILEScopy InChI
Affinity DataIC50: 3.48E+3nMAssay Description:Inhibition of recombinant N-terminal GST-tagged human AKR1C3 expressed in Escherichia coli BL21 (DE) Codon Plus RP cells using S-tetralol as substrat...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S46VMTPubMed
TargetAldo-keto reductase family 1 member C2(Homo sapiens (Human))
University of Torino

Curated by ChEMBL
LigandPNGBDBM50462394(CHEMBL4249650)copy SMILEScopy InChI
Affinity DataIC50: 4.29E+3nMAssay Description:Inhibition of recombinant N-terminal GST-tagged human AKR1C2 expressed in Escherichia coli BL21 (DE) Codon Plus RP cells using S-tetralol as substrat...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S46VMTPubMed
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