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Compile Data Set for Download or QSAR

Found 183 hits of ki for UniProtKB: P50336   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359944
PNG
(CHEMBL1926835)
Show SMILES CCOC(=O)Sc1nc2cc(c(F)cc2s1)-n1nc(sc1=O)C(C)(C)C
Show InChI InChI=1S/C16H16FN3O3S3/c1-5-23-15(22)26-13-18-9-7-10(8(17)6-11(9)24-13)20-14(21)25-12(19-20)16(2,3)4/h6-7H,5H2,1-4H3
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40n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of human PPO by capillary electrophoresis method


Bioorg Med Chem 20: 296-304 (2011)


Article DOI: 10.1016/j.bmc.2011.10.079
BindingDB Entry DOI: 10.7270/Q2FJ2H6T
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487197
PNG
(CHEMBL2252322)
Show SMILES CCCOc1cc(N2CC3=C(CCCC3)C2=O)c(F)cc1Cl |t:9|
Show InChI InChI=1S/C17H19ClFNO2/c1-2-7-22-16-9-15(14(19)8-13(16)18)20-10-11-5-3-4-6-12(11)17(20)21/h8-9H,2-7,10H2,1H3
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95n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487197
PNG
(CHEMBL2252322)
Show SMILES CCCOc1cc(N2CC3=C(CCCC3)C2=O)c(F)cc1Cl |t:9|
Show InChI InChI=1S/C17H19ClFNO2/c1-2-7-22-16-9-15(14(19)8-13(16)18)20-10-11-5-3-4-6-12(11)17(20)21/h8-9H,2-7,10H2,1H3
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95n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487195
PNG
(CHEMBL2252323)
Show SMILES Fc1cc(Cl)c(OCC=C)cc1N1CC2=C(CCCC2)C1=O |t:15|
Show InChI InChI=1S/C17H17ClFNO2/c1-2-7-22-16-9-15(14(19)8-13(16)18)20-10-11-5-3-4-6-12(11)17(20)21/h2,8-9H,1,3-7,10H2
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120n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487195
PNG
(CHEMBL2252323)
Show SMILES Fc1cc(Cl)c(OCC=C)cc1N1CC2=C(CCCC2)C1=O |t:15|
Show InChI InChI=1S/C17H17ClFNO2/c1-2-7-22-16-9-15(14(19)8-13(16)18)20-10-11-5-3-4-6-12(11)17(20)21/h2,8-9H,1,3-7,10H2
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120n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487200
PNG
(CHEMBL2252320)
Show SMILES CCOc1cc(N2CC3=C(CCCC3)C2=O)c(F)cc1Cl |t:8|
Show InChI InChI=1S/C16H17ClFNO2/c1-2-21-15-8-14(13(18)7-12(15)17)19-9-10-5-3-4-6-11(10)16(19)20/h7-8H,2-6,9H2,1H3
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200n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487200
PNG
(CHEMBL2252320)
Show SMILES CCOc1cc(N2CC3=C(CCCC3)C2=O)c(F)cc1Cl |t:8|
Show InChI InChI=1S/C16H17ClFNO2/c1-2-21-15-8-14(13(18)7-12(15)17)19-9-10-5-3-4-6-11(10)16(19)20/h7-8H,2-6,9H2,1H3
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200n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359953
PNG
(CHEMBL1926845)
Show SMILES CCOC(=O)Sc1nc2cc(c(Cl)cc2s1)-n1nc(sc1=O)C(C)(C)C
Show InChI InChI=1S/C16H16ClN3O3S3/c1-5-23-15(22)26-13-18-9-7-10(8(17)6-11(9)24-13)20-14(21)25-12(19-20)16(2,3)4/h6-7H,5H2,1-4H3
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200n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of human PPO by capillary electrophoresis method


Bioorg Med Chem 20: 296-304 (2011)


Article DOI: 10.1016/j.bmc.2011.10.079
BindingDB Entry DOI: 10.7270/Q2FJ2H6T
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359932
PNG
(CHEMBL1926967)
Show SMILES CCOC(=O)CCSc1nc2cc(c(Cl)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C18H20ClN3O4S2/c1-5-25-14(23)6-7-27-16-20-11-9-12(10(19)8-13(11)28-16)22-17(24)26-15(21-22)18(2,3)4/h8-9H,5-7H2,1-4H3
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250n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359932
PNG
(CHEMBL1926967)
Show SMILES CCOC(=O)CCSc1nc2cc(c(Cl)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C18H20ClN3O4S2/c1-5-25-14(23)6-7-27-16-20-11-9-12(10(19)8-13(11)28-16)22-17(24)26-15(21-22)18(2,3)4/h8-9H,5-7H2,1-4H3
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250n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of human PPO by capillary electrophoresis method


Bioorg Med Chem 20: 296-304 (2011)


Article DOI: 10.1016/j.bmc.2011.10.079
BindingDB Entry DOI: 10.7270/Q2FJ2H6T
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359932
PNG
(CHEMBL1926967)
Show SMILES CCOC(=O)CCSc1nc2cc(c(Cl)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C18H20ClN3O4S2/c1-5-25-14(23)6-7-27-16-20-11-9-12(10(19)8-13(11)28-16)22-17(24)26-15(21-22)18(2,3)4/h8-9H,5-7H2,1-4H3
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251n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487192
PNG
(CHEMBL2252321)
Show SMILES CCCOc1cc(N2CC3=C(CCCC3)C2=O)c(Cl)cc1Cl |t:9|
Show InChI InChI=1S/C17H19Cl2NO2/c1-2-7-22-16-9-15(13(18)8-14(16)19)20-10-11-5-3-4-6-12(11)17(20)21/h8-9H,2-7,10H2,1H3
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300n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487192
PNG
(CHEMBL2252321)
Show SMILES CCCOc1cc(N2CC3=C(CCCC3)C2=O)c(Cl)cc1Cl |t:9|
Show InChI InChI=1S/C17H19Cl2NO2/c1-2-7-22-16-9-15(13(18)8-14(16)19)20-10-11-5-3-4-6-12(11)17(20)21/h8-9H,2-7,10H2,1H3
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302n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359925
PNG
(CHEMBL1926960)
Show SMILES CCOC(=O)CCSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C18H20FN3O4S2/c1-5-25-14(23)6-7-27-16-20-11-9-12(10(19)8-13(11)28-16)22-17(24)26-15(21-22)18(2,3)4/h8-9H,5-7H2,1-4H3
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320n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of human PPO by capillary electrophoresis method


Bioorg Med Chem 20: 296-304 (2011)


Article DOI: 10.1016/j.bmc.2011.10.079
BindingDB Entry DOI: 10.7270/Q2FJ2H6T
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359925
PNG
(CHEMBL1926960)
Show SMILES CCOC(=O)CCSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C18H20FN3O4S2/c1-5-25-14(23)6-7-27-16-20-11-9-12(10(19)8-13(11)28-16)22-17(24)26-15(21-22)18(2,3)4/h8-9H,5-7H2,1-4H3
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320n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359925
PNG
(CHEMBL1926960)
Show SMILES CCOC(=O)CCSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C18H20FN3O4S2/c1-5-25-14(23)6-7-27-16-20-11-9-12(10(19)8-13(11)28-16)22-17(24)26-15(21-22)18(2,3)4/h8-9H,5-7H2,1-4H3
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324n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359928
PNG
(CHEMBL1926963)
Show SMILES CCOC(=O)Sc1nc2cc(c(Cl)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C16H16ClN3O4S2/c1-5-23-15(22)26-13-18-9-7-10(8(17)6-11(9)25-13)20-14(21)24-12(19-20)16(2,3)4/h6-7H,5H2,1-4H3
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330n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359928
PNG
(CHEMBL1926963)
Show SMILES CCOC(=O)Sc1nc2cc(c(Cl)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C16H16ClN3O4S2/c1-5-23-15(22)26-13-18-9-7-10(8(17)6-11(9)25-13)20-14(21)24-12(19-20)16(2,3)4/h6-7H,5H2,1-4H3
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330n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of human PPO by capillary electrophoresis method


Bioorg Med Chem 20: 296-304 (2011)


Article DOI: 10.1016/j.bmc.2011.10.079
BindingDB Entry DOI: 10.7270/Q2FJ2H6T
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359928
PNG
(CHEMBL1926963)
Show SMILES CCOC(=O)Sc1nc2cc(c(Cl)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C16H16ClN3O4S2/c1-5-23-15(22)26-13-18-9-7-10(8(17)6-11(9)25-13)20-14(21)24-12(19-20)16(2,3)4/h6-7H,5H2,1-4H3
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331n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359945
PNG
(CHEMBL1926837)
Show SMILES CCOC(=O)CSc1nc2cc(c(F)cc2s1)-n1nc(sc1=O)C(C)(C)C
Show InChI InChI=1S/C17H18FN3O3S3/c1-5-24-13(22)8-25-15-19-10-7-11(9(18)6-12(10)26-15)21-16(23)27-14(20-21)17(2,3)4/h6-7H,5,8H2,1-4H3
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340n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of human PPO by capillary electrophoresis method


Bioorg Med Chem 20: 296-304 (2011)


Article DOI: 10.1016/j.bmc.2011.10.079
BindingDB Entry DOI: 10.7270/Q2FJ2H6T
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359926
PNG
(CHEMBL1926961)
Show SMILES CCOC(=O)CCCSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C19H22FN3O4S2/c1-5-26-15(24)7-6-8-28-17-21-12-10-13(11(20)9-14(12)29-17)23-18(25)27-16(22-23)19(2,3)4/h9-10H,5-8H2,1-4H3
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360n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of human PPO by capillary electrophoresis method


Bioorg Med Chem 20: 296-304 (2011)


Article DOI: 10.1016/j.bmc.2011.10.079
BindingDB Entry DOI: 10.7270/Q2FJ2H6T
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487211
PNG
(CHEMBL2252326)
Show SMILES OC1N(C(=O)C2=C1CCCC2)c1cc(OCc2cccc(Cl)c2)c(Cl)cc1F |c:5|
Show InChI InChI=1S/C21H18Cl2FNO3/c22-13-5-3-4-12(8-13)11-28-19-10-18(17(24)9-16(19)23)25-20(26)14-6-1-2-7-15(14)21(25)27/h3-5,8-10,20,26H,1-2,6-7,11H2
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525n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487211
PNG
(CHEMBL2252326)
Show SMILES OC1N(C(=O)C2=C1CCCC2)c1cc(OCc2cccc(Cl)c2)c(Cl)cc1F |c:5|
Show InChI InChI=1S/C21H18Cl2FNO3/c22-13-5-3-4-12(8-13)11-28-19-10-18(17(24)9-16(19)23)25-20(26)14-6-1-2-7-15(14)21(25)27/h3-5,8-10,20,26H,1-2,6-7,11H2
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530n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487204
PNG
(CHEMBL2252319)
Show SMILES CCOc1cc(N2CC3=C(CCCC3)C2=O)c(Cl)cc1Cl |t:8|
Show InChI InChI=1S/C16H17Cl2NO2/c1-2-21-15-8-14(12(17)7-13(15)18)19-9-10-5-3-4-6-11(10)16(19)20/h7-8H,2-6,9H2,1H3
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670n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487204
PNG
(CHEMBL2252319)
Show SMILES CCOc1cc(N2CC3=C(CCCC3)C2=O)c(Cl)cc1Cl |t:8|
Show InChI InChI=1S/C16H17Cl2NO2/c1-2-21-15-8-14(12(17)7-13(15)18)19-9-10-5-3-4-6-11(10)16(19)20/h7-8H,2-6,9H2,1H3
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676n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487199
PNG
(CHEMBL2252347)
Show SMILES CC(C)Oc1cc(N2CC3=C(CCCC3)C2=O)c(F)cc1Cl |t:9|
Show InChI InChI=1S/C17H19ClFNO2/c1-10(2)22-16-8-15(14(19)7-13(16)18)20-9-11-5-3-4-6-12(11)17(20)21/h7-8,10H,3-6,9H2,1-2H3
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690n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487199
PNG
(CHEMBL2252347)
Show SMILES CC(C)Oc1cc(N2CC3=C(CCCC3)C2=O)c(F)cc1Cl |t:9|
Show InChI InChI=1S/C17H19ClFNO2/c1-10(2)22-16-8-15(14(19)7-13(16)18)20-9-11-5-3-4-6-12(11)17(20)21/h7-8,10H,3-6,9H2,1-2H3
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692n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359926
PNG
(CHEMBL1926961)
Show SMILES CCOC(=O)CCCSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C19H22FN3O4S2/c1-5-26-15(24)7-6-8-28-17-21-12-10-13(11(20)9-14(12)29-17)23-18(25)27-16(22-23)19(2,3)4/h9-10H,5-8H2,1-4H3
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700n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359924
PNG
(CHEMBL1926863)
Show SMILES CCCOC(=O)CSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C18H20FN3O4S2/c1-5-6-25-14(23)9-27-16-20-11-8-12(10(19)7-13(11)28-16)22-17(24)26-15(21-22)18(2,3)4/h7-8H,5-6,9H2,1-4H3
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700n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359924
PNG
(CHEMBL1926863)
Show SMILES CCCOC(=O)CSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C18H20FN3O4S2/c1-5-6-25-14(23)9-27-16-20-11-8-12(10(19)7-13(11)28-16)22-17(24)26-15(21-22)18(2,3)4/h7-8H,5-6,9H2,1-4H3
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700n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of human PPO by capillary electrophoresis method


Bioorg Med Chem 20: 296-304 (2011)


Article DOI: 10.1016/j.bmc.2011.10.079
BindingDB Entry DOI: 10.7270/Q2FJ2H6T
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359926
PNG
(CHEMBL1926961)
Show SMILES CCOC(=O)CCCSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C19H22FN3O4S2/c1-5-26-15(24)7-6-8-28-17-21-12-10-13(11(20)9-14(12)29-17)23-18(25)27-16(22-23)19(2,3)4/h9-10H,5-8H2,1-4H3
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708n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359924
PNG
(CHEMBL1926863)
Show SMILES CCCOC(=O)CSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C18H20FN3O4S2/c1-5-6-25-14(23)9-27-16-20-11-8-12(10(19)7-13(11)28-16)22-17(24)26-15(21-22)18(2,3)4/h7-8H,5-6,9H2,1-4H3
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708n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50486212
PNG
(CHEBI:9339 | SULFENTRAZONE)
Show SMILES Cc1nn(-c2cc(NS(C)(=O)=O)c(Cl)cc2Cl)c(=O)n1C(F)F
Show InChI InChI=1S/C11H10Cl2F2N4O3S/c1-5-16-19(11(20)18(5)10(14)15)9-4-8(17-23(2,21)22)6(12)3-7(9)13/h3-4,10,17H,1-2H3
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720n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50486212
PNG
(CHEBI:9339 | SULFENTRAZONE)
Show SMILES Cc1nn(-c2cc(NS(C)(=O)=O)c(Cl)cc2Cl)c(=O)n1C(F)F
Show InChI InChI=1S/C11H10Cl2F2N4O3S/c1-5-16-19(11(20)18(5)10(14)15)9-4-8(17-23(2,21)22)6(12)3-7(9)13/h3-4,10,17H,1-2H3
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720n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359918
PNG
(CHEMBL1926857)
Show SMILES CCOC(=O)Sc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C16H16FN3O4S2/c1-5-23-15(22)26-13-18-9-7-10(8(17)6-11(9)25-13)20-14(21)24-12(19-20)16(2,3)4/h6-7H,5H2,1-4H3
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720n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of human PPO by capillary electrophoresis method


Bioorg Med Chem 20: 296-304 (2011)


Article DOI: 10.1016/j.bmc.2011.10.079
BindingDB Entry DOI: 10.7270/Q2FJ2H6T
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50486208
PNG
(CHEMBL2230219)
Show SMILES COC(=O)Sc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C15H14FN3O4S2/c1-15(2,3)11-18-19(13(20)23-11)9-6-8-10(5-7(9)16)24-12(17-8)25-14(21)22-4/h5-6H,1-4H3
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720n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50486208
PNG
(CHEMBL2230219)
Show SMILES COC(=O)Sc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C15H14FN3O4S2/c1-15(2,3)11-18-19(13(20)23-11)9-6-8-10(5-7(9)16)24-12(17-8)25-14(21)22-4/h5-6H,1-4H3
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724n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50486212
PNG
(CHEBI:9339 | SULFENTRAZONE)
Show SMILES Cc1nn(-c2cc(NS(C)(=O)=O)c(Cl)cc2Cl)c(=O)n1C(F)F
Show InChI InChI=1S/C11H10Cl2F2N4O3S/c1-5-16-19(11(20)18(5)10(14)15)9-4-8(17-23(2,21)22)6(12)3-7(9)13/h3-4,10,17H,1-2H3
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724n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487215
PNG
(CHEMBL2252325)
Show SMILES OC1N(C(=O)C2=C1CCCC2)c1cc(OCc2cccc(F)c2)c(Cl)cc1F |c:5|
Show InChI InChI=1S/C21H18ClF2NO3/c22-16-9-17(24)18(10-19(16)28-11-12-4-3-5-13(23)8-12)25-20(26)14-6-1-2-7-15(14)21(25)27/h3-5,8-10,20,26H,1-2,6-7,11H2
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776n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487215
PNG
(CHEMBL2252325)
Show SMILES OC1N(C(=O)C2=C1CCCC2)c1cc(OCc2cccc(F)c2)c(Cl)cc1F |c:5|
Show InChI InChI=1S/C21H18ClF2NO3/c22-16-9-17(24)18(10-19(16)28-11-12-4-3-5-13(23)8-12)25-20(26)14-6-1-2-7-15(14)21(25)27/h3-5,8-10,20,26H,1-2,6-7,11H2
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780n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50486209
PNG
(CHEMBL2230215)
Show SMILES CC(C)(C)OC(=O)CSc1nc2cc(c(Cl)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C19H22ClN3O4S2/c1-18(2,3)15-22-23(17(25)26-15)12-8-11-13(7-10(12)20)29-16(21-11)28-9-14(24)27-19(4,5)6/h7-8H,9H2,1-6H3
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832n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50486209
PNG
(CHEMBL2230215)
Show SMILES CC(C)(C)OC(=O)CSc1nc2cc(c(Cl)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C19H22ClN3O4S2/c1-18(2,3)15-22-23(17(25)26-15)12-8-11-13(7-10(12)20)29-16(21-11)28-9-14(24)27-19(4,5)6/h7-8H,9H2,1-6H3
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840n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50486204
PNG
(CHEMBL2230211)
Show SMILES CCCOC(=O)CSc1nc2cc(c(Cl)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C18H20ClN3O4S2/c1-5-6-25-14(23)9-27-16-20-11-8-12(10(19)7-13(11)28-16)22-17(24)26-15(21-22)18(2,3)4/h7-8H,5-6,9H2,1-4H3
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977n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50486204
PNG
(CHEMBL2230211)
Show SMILES CCCOC(=O)CSc1nc2cc(c(Cl)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C18H20ClN3O4S2/c1-5-6-25-14(23)9-27-16-20-11-8-12(10(19)7-13(11)28-16)22-17(24)26-15(21-22)18(2,3)4/h7-8H,5-6,9H2,1-4H3
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980n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359929
PNG
(CHEMBL1926964)
Show SMILES CCOC(=O)CSc1nc2cc(c(Cl)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C17H18ClN3O4S2/c1-5-24-13(22)8-26-15-19-10-7-11(9(18)6-12(10)27-15)21-16(23)25-14(20-21)17(2,3)4/h6-7H,5,8H2,1-4H3
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1.00E+3n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50359929
PNG
(CHEMBL1926964)
Show SMILES CCOC(=O)CSc1nc2cc(c(Cl)cc2s1)-n1nc(oc1=O)C(C)(C)C
Show InChI InChI=1S/C17H18ClN3O4S2/c1-5-24-13(22)8-26-15-19-10-7-11(9(18)6-12(10)27-15)21-16(23)25-14(20-21)17(2,3)4/h6-7H,5,8H2,1-4H3
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1.01E+3n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...


J Agric Food Chem 58: 2643-51 (2010)


Article DOI: 10.1021/jf9026298
BindingDB Entry DOI: 10.7270/Q2ZW1PS7
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487188
PNG
(CHEMBL2252331)
Show SMILES COC1N(C(=O)C2=C1CCCC2)c1cc(OCc2cccc(Cl)c2)c(Cl)cc1F |c:6|
Show InChI InChI=1S/C22H20Cl2FNO3/c1-28-22-16-8-3-2-7-15(16)21(27)26(22)19-11-20(17(24)10-18(19)25)29-12-13-5-4-6-14(23)9-13/h4-6,9-11,22H,2-3,7-8,12H2,1H3
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1.02E+3n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487190
PNG
(CHEMBL2252328)
Show SMILES OC1N(C(=O)C2=C1CCCC2)c1cc(OCC=C)c(Cl)cc1F |c:5|
Show InChI InChI=1S/C17H17ClFNO3/c1-2-7-23-15-9-14(13(19)8-12(15)18)20-16(21)10-5-3-4-6-11(10)17(20)22/h2,8-9,16,21H,1,3-7H2
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1.02E+3n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487190
PNG
(CHEMBL2252328)
Show SMILES OC1N(C(=O)C2=C1CCCC2)c1cc(OCC=C)c(Cl)cc1F |c:5|
Show InChI InChI=1S/C17H17ClFNO3/c1-2-7-23-15-9-14(13(19)8-12(15)18)20-16(21)10-5-3-4-6-11(10)17(20)22/h2,8-9,16,21H,1,3-7H2
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1.03E+3n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
Protoporphyrinogen oxidase


(Homo sapiens (Human))
BDBM50487188
PNG
(CHEMBL2252331)
Show SMILES COC1N(C(=O)C2=C1CCCC2)c1cc(OCc2cccc(Cl)c2)c(Cl)cc1F |c:6|
Show InChI InChI=1S/C22H20Cl2FNO3/c1-28-22-16-8-3-2-7-15(16)21(27)26(22)19-11-20(17(24)10-18(19)25)29-12-13-5-4-6-14(23)9-13/h4-6,9-11,22H,2-3,7-8,12H2,1H3
PDB
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1.03E+3n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of Homo sapiens (human) protoporphyrinogen oxidase


Bioorg Med Chem 18: 7948-56 (2010)


Article DOI: 10.1016/j.bmc.2010.09.036
BindingDB Entry DOI: 10.7270/Q2QZ2DT8
More data for this
Ligand-Target Pair
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