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Found 172 hits Enz. Inhib. hit(s) with Target = 'Luciferin 4-monooxygenase'   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004836
PNG
(CHEMBL2324047)
Show SMILES Clc1ccc(cc1)C1=NO[C@H](Cc2ccccc2)C1
Show InChI InChI=1S/C16H14ClNO/c17-14-8-6-13(7-9-14)16-11-15(19-18-16)10-12-4-2-1-3-5-12/h1-9,15H,10-11H2/t15-/m1/s1
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Article
PubMed
n/an/a 0.260n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004877
PNG
(CHEMBL2324088)
Show SMILES COc1ccc(cc1)C1=NO[C@H](Cc2ccccc2)C1
Show InChI InChI=1S/C17H17NO2/c1-19-15-9-7-14(8-10-15)17-12-16(20-18-17)11-13-5-3-2-4-6-13/h2-10,16H,11-12H2,1H3/t16-/m1/s1
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Article
PubMed
n/an/a 0.290n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004876
PNG
(CHEMBL2324042)
Show SMILES Fc1ccc(cc1)C1=NO[C@H](Cc2ccccc2)C1
Show InChI InChI=1S/C16H14FNO/c17-14-8-6-13(7-9-14)16-11-15(19-18-16)10-12-4-2-1-3-5-12/h1-9,15H,10-11H2/t15-/m1/s1
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Article
PubMed
n/an/a 0.310n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004875
PNG
(CHEMBL2324086)
Show SMILES COc1cccc(c1)C1=NO[C@H](Cc2ccccc2)C1
Show InChI InChI=1S/C17H17NO2/c1-19-15-9-5-8-14(11-15)17-12-16(20-18-17)10-13-6-3-2-4-7-13/h2-9,11,16H,10,12H2,1H3/t16-/m1/s1
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PubMed
n/an/a 0.400n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004874
PNG
(CHEMBL2324045)
Show SMILES Clc1ccccc1C1=NOC(Cc2ccccc2)O1
Show InChI InChI=1S/C15H12ClNO2/c16-13-9-5-4-8-12(13)15-17-19-14(18-15)10-11-6-2-1-3-7-11/h1-9,14H,10H2
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n/an/a 0.520n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004873
PNG
(CHEMBL2324053)
Show SMILES [O-][N+](=O)c1ccc(cc1)C1=NOC(Cc2ccccc2)C1
Show InChI InChI=1S/C16H14N2O3/c19-18(20)14-8-6-13(7-9-14)16-11-15(21-17-16)10-12-4-2-1-3-5-12/h1-9,15H,10-11H2
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PubMed
n/an/a 0.740n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004872
PNG
(CHEMBL2324097)
Show SMILES Oc1cccc(c1)C1=NO[C@H](Cc2ccccc2)C1
Show InChI InChI=1S/C16H15NO2/c18-14-8-4-7-13(10-14)16-11-15(19-17-16)9-12-5-2-1-3-6-12/h1-8,10,15,18H,9,11H2/t15-/m1/s1
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PubMed
n/an/a 0.830n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004871
PNG
(CHEMBL2324068)
Show SMILES Fc1ccc(C[C@@H]2CC(=NO2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C16H13ClFNO/c17-13-5-3-12(4-6-13)16-10-15(20-19-16)9-11-1-7-14(18)8-2-11/h1-8,15H,9-10H2/t15-/m1/s1
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PubMed
n/an/a 0.870n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004870
PNG
(CHEMBL2324051)
Show SMILES N#Cc1ccc(cc1)C1=NO[C@H](Cc2ccccc2)C1
Show InChI InChI=1S/C17H14N2O/c18-12-14-6-8-15(9-7-14)17-11-16(20-19-17)10-13-4-2-1-3-5-13/h1-9,16H,10-11H2/t16-/m1/s1
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PubMed
n/an/a 0.890n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004869
PNG
(CHEMBL2324082)
Show SMILES COc1ccccc1C1=NO[C@H](Cc2ccccc2)C1
Show InChI InChI=1S/C17H17NO2/c1-19-17-10-6-5-9-15(17)16-12-14(20-18-16)11-13-7-3-2-4-8-13/h2-10,14H,11-12H2,1H3/t14-/m1/s1
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PubMed
n/an/a 0.910n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004868
PNG
(CHEMBL2324044)
Show SMILES Clc1ccccc1C1=NOC(Cc2ccccc2)C1
Show InChI InChI=1S/C16H14ClNO/c17-15-9-5-4-8-14(15)16-11-13(19-18-16)10-12-6-2-1-3-7-12/h1-9,13H,10-11H2
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PubMed
n/an/a 0.930n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004867
PNG
(CHEMBL2324092)
Show SMILES COc1ccc(cc1)C1=NO[C@H](Cc2ccccc2)O1
Show InChI InChI=1S/C16H15NO3/c1-18-14-9-7-13(8-10-14)16-17-20-15(19-16)11-12-5-3-2-4-6-12/h2-10,15H,11H2,1H3/t15-/m1/s1
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PubMed
n/an/a 0.950n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004865
PNG
(CHEMBL2324104)
Show SMILES Fc1cccc(c1)C1=NO[C@H](Cc2ccccc2)C1
Show InChI InChI=1S/C16H14FNO/c17-14-8-4-7-13(10-14)16-11-15(19-18-16)9-12-5-2-1-3-6-12/h1-8,10,15H,9,11H2/t15-/m1/s1
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Article
PubMed
n/an/a 0.950n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004866
PNG
(CHEMBL2324101)
Show SMILES Fc1ccccc1C1=NO[C@H](Cc2ccccc2)C1
Show InChI InChI=1S/C16H14FNO/c17-15-9-5-4-8-14(15)16-11-13(19-18-16)10-12-6-2-1-3-7-12/h1-9,13H,10-11H2/t13-/m1/s1
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PubMed
n/an/a 0.950n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004864
PNG
(CHEMBL2324058)
Show SMILES COc1ccc(cc1)C1=NO[C@H](Cc2cccc(OC)c2)C1
Show InChI InChI=1S/C18H19NO3/c1-20-15-8-6-14(7-9-15)18-12-17(22-19-18)11-13-4-3-5-16(10-13)21-2/h3-10,17H,11-12H2,1-2H3/t17-/m1/s1
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PubMed
n/an/a 1.20n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004862
PNG
(CHEMBL2324076)
Show SMILES C([C@@H]1CC(=NO1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C16H15NO/c1-3-7-13(8-4-1)11-15-12-16(17-18-15)14-9-5-2-6-10-14/h1-10,15H,11-12H2/t15-/m1/s1
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Article
PubMed
n/an/a 1.60n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004861
PNG
(CHEMBL2324056)
Show SMILES COc1ccc(cc1)C1=NO[C@H](Cc2ccccc2OC)C1
Show InChI InChI=1S/C18H19NO3/c1-20-15-9-7-13(8-10-15)17-12-16(22-19-17)11-14-5-3-4-6-18(14)21-2/h3-10,16H,11-12H2,1-2H3/t16-/m1/s1
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PubMed
n/an/a 1.80n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004860
PNG
(CHEMBL2324095)
Show SMILES Oc1ccccc1C1=NO[C@H](Cc2ccccc2)C1
Show InChI InChI=1S/C16H15NO2/c18-16-9-5-4-8-14(16)15-11-13(19-17-15)10-12-6-2-1-3-7-12/h1-9,13,18H,10-11H2/t13-/m1/s1
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PubMed
n/an/a 1.90n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004859
PNG
(CHEMBL2324084)
Show SMILES COc1ccccc1C1=NO[C@H](Cc2ccccc2)O1
Show InChI InChI=1S/C16H15NO3/c1-18-14-10-6-5-9-13(14)16-17-20-15(19-16)11-12-7-3-2-4-8-12/h2-10,15H,11H2,1H3/t15-/m1/s1
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PubMed
n/an/a 2.10n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004858
PNG
(CHEMBL2324103)
Show SMILES Fc1ccccc1C1=NOC(Cc2ccccc2)O1
Show InChI InChI=1S/C15H12FNO2/c16-13-9-5-4-8-12(13)15-17-19-14(18-15)10-11-6-2-1-3-7-11/h1-9,14H,10H2
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n/an/a 2.80n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004857
PNG
(CHEMBL2324093)
Show SMILES COc1ccc(cc1)C1=NO[C@@H](Cc2ccccc2)O1
Show InChI InChI=1S/C16H15NO3/c1-18-14-9-7-13(8-10-14)16-17-20-15(19-16)11-12-5-3-2-4-6-12/h2-10,15H,11H2,1H3/t15-/m0/s1
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n/an/a 5.20n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004856
PNG
(CHEMBL2324054)
Show SMILES COc1ccc(cc1)C1=NO[C@H](Cc2ccc(F)cc2)C1
Show InChI InChI=1S/C17H16FNO2/c1-20-15-8-4-13(5-9-15)17-11-16(21-19-17)10-12-2-6-14(18)7-3-12/h2-9,16H,10-11H2,1H3/t16-/m1/s1
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n/an/a 10n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004855
PNG
(CHEMBL2324090)
Show SMILES COc1ccc(cc1)C1=NO[C@H](CCc2ccccc2)C1
Show InChI InChI=1S/C18H19NO2/c1-20-16-11-8-15(9-12-16)18-13-17(21-19-18)10-7-14-5-3-2-4-6-14/h2-6,8-9,11-12,17H,7,10,13H2,1H3/t17-/m1/s1
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PubMed
n/an/a 14n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004854
PNG
(CHEMBL2324046)
Show SMILES Clc1cccc(c1)C1=NOC(Cc2ccccc2)C1
Show InChI InChI=1S/C16H14ClNO/c17-14-8-4-7-13(10-14)16-11-15(19-18-16)9-12-5-2-1-3-6-12/h1-8,10,15H,9,11H2
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PubMed
n/an/a 15n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004853
PNG
(CHEMBL2324062)
Show SMILES COc1ccccc1CC1CC(=NO1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H16ClNO2/c1-20-17-5-3-2-4-13(17)10-15-11-16(19-21-15)12-6-8-14(18)9-7-12/h2-9,15H,10-11H2,1H3
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PubMed
n/an/a 16n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004851
PNG
(CHEMBL2324063)
Show SMILES COc1cccc(C[C@@H]2CC(=NO2)c2ccc(Cl)cc2)c1
Show InChI InChI=1S/C17H16ClNO2/c1-20-15-4-2-3-12(9-15)10-16-11-17(19-21-16)13-5-7-14(18)8-6-13/h2-9,16H,10-11H2,1H3/t16-/m1/s1
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n/an/a 17n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004850
PNG
(CHEMBL2324094)
Show SMILES COc1ccc(cc1)C1=NOC(C)(Cc2ccccc2)C1
Show InChI InChI=1S/C18H19NO2/c1-18(12-14-6-4-3-5-7-14)13-17(19-21-18)15-8-10-16(20-2)11-9-15/h3-11H,12-13H2,1-2H3
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n/an/a 22n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004849
PNG
(CHEMBL2324050)
Show SMILES CC1(Cc2ccccc2)CC(=NO1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H16ClNO/c1-17(11-13-5-3-2-4-6-13)12-16(19-20-17)14-7-9-15(18)10-8-14/h2-10H,11-12H2,1H3
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n/an/a 32n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photuris pennsylvanica)
BDBM50238226
PNG
(2-(5-biphenyl-4-yl-[1,2,4]oxadiazol-3-yl)-pyridine...)
Show SMILES c1ccc(cc1)-c1ccc(cc1)-c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C19H13N3O/c1-2-6-14(7-3-1)15-9-11-16(12-10-15)19-21-18(22-23-19)17-8-4-5-13-20-17/h1-13H
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n/an/a 38n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photuris pennsylvanica luciferase by noncompetitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photuris pennsylvanica)
BDBM50293100
PNG
(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl biphenyl-4-c...)
Show SMILES O=C(Oc1nc(no1)-c1ccccn1)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H13N3O3/c24-19(16-11-9-15(10-12-16)14-6-2-1-3-7-14)25-20-22-18(23-26-20)17-8-4-5-13-21-17/h1-13H
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n/an/a 40n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photuris pennsylvanica luciferase by noncompetitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photuris pennsylvanica)
BDBM50293101
PNG
(5-(2,4-dimethoxyphenyl)-3-phenyl-1,2,4-oxadiazole ...)
Show SMILES COc1ccc(-c2nc(no2)-c2ccccc2)c(OC)c1
Show InChI InChI=1S/C16H14N2O3/c1-19-12-8-9-13(14(10-12)20-2)16-17-15(18-21-16)11-6-4-3-5-7-11/h3-10H,1-2H3
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n/an/a 54n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photuris pennsylvanica luciferase by noncompetitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM23926
PNG
((E)-resveratrol | 5-[(E)-2-(4-hydroxyphenyl)etheny...)
Show SMILES Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1
Show InChI InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+
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n/an/a 59n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50238226
PNG
(2-(5-biphenyl-4-yl-[1,2,4]oxadiazol-3-yl)-pyridine...)
Show SMILES c1ccc(cc1)-c1ccc(cc1)-c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C19H13N3O/c1-2-6-14(7-3-1)15-9-11-16(12-10-15)19-21-18(22-23-19)17-8-4-5-13-20-17/h1-13H
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n/an/a 80n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photinus pyralis luciferase by noncompetitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photuris pennsylvanica)
BDBM50293102
PNG
(5-(2-methoxyphenyl)-3-(pyridin-2-yl)-1,2,4-oxadiaz...)
Show SMILES COc1ccccc1-c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C14H11N3O2/c1-18-12-8-3-2-6-10(12)14-16-13(17-19-14)11-7-4-5-9-15-11/h2-9H,1H3
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n/an/a 80n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photuris pennsylvanica luciferase by noncompetitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004848
PNG
(CHEMBL2324080)
Show SMILES C([C@@H]1CC(=NO1)c1ccc2ccccc2c1)c1ccccc1
Show InChI InChI=1S/C20H17NO/c1-2-6-15(7-3-1)12-19-14-20(21-22-19)18-11-10-16-8-4-5-9-17(16)13-18/h1-11,13,19H,12,14H2/t19-/m1/s1
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n/an/a 87n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004847
PNG
(CHEMBL2324077)
Show SMILES C([C@H]1CC(=NO1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C16H15NO/c1-3-7-13(8-4-1)11-15-12-16(17-18-15)14-9-5-2-6-10-14/h1-10,15H,11-12H2/t15-/m0/s1
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n/an/a 174n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50293101
PNG
(5-(2,4-dimethoxyphenyl)-3-phenyl-1,2,4-oxadiazole ...)
Show SMILES COc1ccc(-c2nc(no2)-c2ccccc2)c(OC)c1
Show InChI InChI=1S/C16H14N2O3/c1-19-12-8-9-13(14(10-12)20-2)16-17-15(18-21-16)11-6-4-3-5-7-11/h3-10H,1-2H3
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n/an/a 200n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photinus pyralis luciferase by noncompetitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50129791
PNG
((4-Benzothiazol-2-yl-phenyl)-dimethyl-amine | 4-(B...)
Show SMILES CN(C)c1ccc(cc1)-c1nc2ccccc2s1
Show InChI InChI=1S/C15H14N2S/c1-17(2)12-9-7-11(8-10-12)15-16-13-5-3-4-6-14(13)18-15/h3-10H,1-2H3
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n/an/a 200n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photinus pyralis luciferase by competitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photuris pennsylvanica)
BDBM50293103
PNG
(5-(2-fluorophenyl)-3-(4-methoxyphenyl)-1,2,4-oxadi...)
Show SMILES COc1ccc(cc1)-c1noc(n1)-c1ccccc1F
Show InChI InChI=1S/C15H11FN2O2/c1-19-11-8-6-10(7-9-11)14-17-15(20-18-14)12-4-2-3-5-13(12)16/h2-9H,1H3
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n/an/a 300n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photuris pennsylvanica luciferase by noncompetitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004846
PNG
(CHEMBL2324099)
Show SMILES Oc1ccc(cc1)C1=NO[C@H](Cc2ccccc2)C1
Show InChI InChI=1S/C16H15NO2/c18-14-8-6-13(7-9-14)16-11-15(19-17-16)10-12-4-2-1-3-5-12/h1-9,15,18H,10-11H2/t15-/m1/s1
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n/an/a 316n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photuris pennsylvanica)
BDBM50129791
PNG
((4-Benzothiazol-2-yl-phenyl)-dimethyl-amine | 4-(B...)
Show SMILES CN(C)c1ccc(cc1)-c1nc2ccccc2s1
Show InChI InChI=1S/C15H14N2S/c1-17(2)12-9-7-11(8-10-12)15-16-13-5-3-4-6-14(13)18-15/h3-10H,1-2H3
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n/an/a 320n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photuris pennsylvanica luciferase by competitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photuris pennsylvanica)
BDBM50293104
PNG
(4-(5-(2-methoxyphenyl)-1,2,4-oxadiazol-3-yl)-N,N-d...)
Show SMILES COc1ccccc1-c1nc(no1)-c1ccc(cc1)N(C)C
Show InChI InChI=1S/C17H17N3O2/c1-20(2)13-10-8-12(9-11-13)16-18-17(22-19-16)14-6-4-5-7-15(14)21-3/h4-11H,1-3H3
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n/an/a 320n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photuris pennsylvanica luciferase by noncompetitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004845
PNG
(CHEMBL2324052)
Show SMILES N#Cc1ccc(cc1)C1=NO[C@@H](Cc2ccccc2)C1
Show InChI InChI=1S/C17H14N2O/c18-12-14-6-8-15(9-7-14)17-11-16(20-19-17)10-13-4-2-1-3-5-13/h1-9,16H,10-11H2/t16-/m0/s1
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n/an/a 331n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photuris pennsylvanica)
BDBM50293105
PNG
(2-(4-Methoxyphenyl)benzo[d]thiazole | CHEMBL460508)
Show SMILES COc1ccc(cc1)-c1nc2ccccc2s1
Show InChI InChI=1S/C14H11NOS/c1-16-11-8-6-10(7-9-11)14-15-12-4-2-3-5-13(12)17-14/h2-9H,1H3
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n/an/a 360n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photuris pennsylvanica luciferase by competitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50004844
PNG
(CHEMBL2324048)
Show SMILES Clc1ccc(cc1)C1=NO[C@@H](Cc2ccccc2)C1
Show InChI InChI=1S/C16H14ClNO/c17-14-8-6-13(7-9-14)16-11-15(19-18-16)10-12-4-2-1-3-5-12/h1-9,15H,10-11H2/t15-/m0/s1
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n/an/a 417n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photuris pennsylvanica)
BDBM50293106
PNG
(2-(2-Fluorophenyl)-6-methoxybenzo[d]thiazole | CHE...)
Show SMILES COc1ccc2nc(sc2c1)-c1ccccc1F
Show InChI InChI=1S/C14H10FNOS/c1-17-9-6-7-12-13(8-9)18-14(16-12)10-4-2-3-5-11(10)15/h2-8H,1H3
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n/an/a 500n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photuris pennsylvanica luciferase by competitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50293104
PNG
(4-(5-(2-methoxyphenyl)-1,2,4-oxadiazol-3-yl)-N,N-d...)
Show SMILES COc1ccccc1-c1nc(no1)-c1ccc(cc1)N(C)C
Show InChI InChI=1S/C17H17N3O2/c1-20(2)13-10-8-12(9-11-13)16-18-17(22-19-16)14-6-4-5-7-15(14)21-3/h4-11H,1-3H3
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n/an/a 500n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photinus pyralis luciferase by noncompetitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photinus pyralis)
BDBM50238214
PNG
((2-(4-ethoxyphenyl)quinolin-4-yl)(4-(pyridin-2-yl)...)
Show SMILES CCOc1ccc(cc1)-c1cc(C(=O)N2CCN(CC2)c2ccccn2)c2ccccc2n1
Show InChI InChI=1S/C27H26N4O2/c1-2-33-21-12-10-20(11-13-21)25-19-23(22-7-3-4-8-24(22)29-25)27(32)31-17-15-30(16-18-31)26-9-5-6-14-28-26/h3-14,19H,2,15-18H2,1H3
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n/an/a 500n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of adenylate binding site of Photinus pyralis luciferase by quantitative high throughput screening


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photuris pennsylvanica)
BDBM50293107
PNG
(5-(4-fluorophenyl)-3-m-tolyl-1,2,4-oxadiazole | CH...)
Show SMILES Cc1cccc(c1)-c1noc(n1)-c1ccc(F)cc1
Show InChI InChI=1S/C15H11FN2O/c1-10-3-2-4-12(9-10)14-17-15(19-18-14)11-5-7-13(16)8-6-11/h2-9H,1H3
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n/an/a 580n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photuris pennsylvanica luciferase by noncompetitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
Luciferin 4-monooxygenase


(Photuris pennsylvanica)
BDBM50293108
PNG
(3-(2-methoxyphenyl)-5-phenyl-1,2,4-oxadiazole | CH...)
Show SMILES COc1ccccc1-c1noc(n1)-c1ccccc1
Show InChI InChI=1S/C15H12N2O2/c1-18-13-10-6-5-9-12(13)14-16-15(19-17-14)11-7-3-2-4-8-11/h2-10H,1H3
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n/an/a 600n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of luciferin binding site of Photuris pennsylvanica luciferase by noncompetitive inhibition assay


Citation and Details
More data for this
Ligand-Target Pair
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