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PubMed code 16263280

Compile data set for download or QSAR
Found 12 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
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
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50176388
PNG
(CHEMBL199543 | N'-(2-hydroxy-5-methylbenzylidene)-...)
Show SMILES Cc1ccc(O)c(C=NNC(=O)c2ccc(cc2)C(C)(C)C)c1 |w:7.6|
Show InChI InChI=1S/C19H22N2O2/c1-13-5-10-17(22)15(11-13)12-20-21-18(23)14-6-8-16(9-7-14)19(2,3)4/h5-12,22H,1-4H3,(H,21,23)
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n/an/a 5.00E+4n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
Inhibition of 1-monooleoyl glycerol induced beta-hematin formation


Bioorg Med Chem Lett 16: 31-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.058
BindingDB Entry DOI: 10.7270/Q2K35VWT
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50176380
PNG
(CHEMBL197970 | N'-(4-(diethylamino)-2-hydroxybenzy...)
Show SMILES CCN(CC)c1ccc(C=NNC(=O)c2ccccc2)c(O)c1 |w:9.8|
Show InChI InChI=1S/C18H21N3O2/c1-3-21(4-2)16-11-10-15(17(22)12-16)13-19-20-18(23)14-8-6-5-7-9-14/h5-13,22H,3-4H2,1-2H3,(H,20,23)
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n/an/a 5.00E+4n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
Inhibition of 1-monooleoyl glycerol induced beta-hematin formation


Bioorg Med Chem Lett 16: 31-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.058
BindingDB Entry DOI: 10.7270/Q2K35VWT
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50176385
PNG
(CHEMBL199934 | N'-(5-tert-butyl-2-hydroxybenzylide...)
Show SMILES CC(C)(C)c1ccc(O)c(C=NNC(=O)c2cccs2)c1 |w:10.9|
Show InChI InChI=1S/C16H18N2O2S/c1-16(2,3)12-6-7-13(19)11(9-12)10-17-18-15(20)14-5-4-8-21-14/h4-10,19H,1-3H3,(H,18,20)
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n/an/a 5.00E+4n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
Inhibition of 1-monooleoyl glycerol induced beta-hematin formation


Bioorg Med Chem Lett 16: 31-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.058
BindingDB Entry DOI: 10.7270/Q2K35VWT
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50176381
PNG
(CHEMBL414671 | N'-(5-tert-butyl-2-hydroxybenzylide...)
Show SMILES CC(C)(C)c1ccc(O)c(C=NNC(=O)c2ccc(cc2)[N+]([O-])=O)c1 |w:10.9|
Show InChI InChI=1S/C18H19N3O4/c1-18(2,3)14-6-9-16(22)13(10-14)11-19-20-17(23)12-4-7-15(8-5-12)21(24)25/h4-11,22H,1-3H3,(H,20,23)
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n/an/a 5.00E+4n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
Inhibition of 1-monooleoyl glycerol induced beta-hematin formation


Bioorg Med Chem Lett 16: 31-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.058
BindingDB Entry DOI: 10.7270/Q2K35VWT
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50176378
PNG
(2-hydroxy-5-methyl-benzaldehyde 4-chloro-benzoyl h...)
Show SMILES Cc1ccc(O)c(C=NNC(=O)c2ccc(Cl)cc2)c1 |w:7.6|
Show InChI InChI=1S/C15H13ClN2O2/c1-10-2-7-14(19)12(8-10)9-17-18-15(20)11-3-5-13(16)6-4-11/h2-9,19H,1H3,(H,18,20)
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n/an/a 5.00E+4n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
Inhibition of 1-monooleoyl glycerol induced beta-hematin formation


Bioorg Med Chem Lett 16: 31-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.058
BindingDB Entry DOI: 10.7270/Q2K35VWT
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM22985
PNG
(Aralen | CHEMBL76 | CHLOROQUINE PHOSPHATE | Chloro...)
Show SMILES CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12
Show InChI InChI=1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21)
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n/an/a 6.00E+4n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
Inhibition of 1-monooleoyl glycerol induced beta-hematin formation


Bioorg Med Chem Lett 16: 31-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.058
BindingDB Entry DOI: 10.7270/Q2K35VWT
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50176382
PNG
(CHEMBL440393 | N'-(4-(diethylamino)-2-hydroxybenzy...)
Show SMILES CCN(CC)c1ccc(C=NNC(=O)c2ccc(cc2)[N+]([O-])=O)c(O)c1 |w:9.8|
Show InChI InChI=1S/C18H20N4O4/c1-3-21(4-2)16-10-7-14(17(23)11-16)12-19-20-18(24)13-5-8-15(9-6-13)22(25)26/h5-12,23H,3-4H2,1-2H3,(H,20,24)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
Inhibition of 1-monooleoyl glycerol induced beta-hematin formation


Bioorg Med Chem Lett 16: 31-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.058
BindingDB Entry DOI: 10.7270/Q2K35VWT
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50176387
PNG
(2-hydroxy-4-diethylaminobenzaldehyde 4-tert-butyl-...)
Show SMILES CCN(CC)c1ccc(C=NNC(=O)c2ccc(cc2)C(C)(C)C)c(O)c1 |w:9.8|
Show InChI InChI=1S/C22H29N3O2/c1-6-25(7-2)19-13-10-17(20(26)14-19)15-23-24-21(27)16-8-11-18(12-9-16)22(3,4)5/h8-15,26H,6-7H2,1-5H3,(H,24,27)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
Inhibition of 1-monooleoyl glycerol induced beta-hematin formation


Bioorg Med Chem Lett 16: 31-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.058
BindingDB Entry DOI: 10.7270/Q2K35VWT
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50176379
PNG
(2-hydroxy-5-tert-butyl-benzaldehyde 4-methoxy-benz...)
Show SMILES COc1ccc(cc1)C(=O)NN=Cc1cc(ccc1O)C(C)(C)C |w:12.13|
Show InChI InChI=1S/C19H22N2O3/c1-19(2,3)15-7-10-17(22)14(11-15)12-20-21-18(23)13-5-8-16(24-4)9-6-13/h5-12,22H,1-4H3,(H,21,23)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
Inhibition of 1-monooleoyl glycerol induced beta-hematin formation


Bioorg Med Chem Lett 16: 31-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.058
BindingDB Entry DOI: 10.7270/Q2K35VWT
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50176386
PNG
(CHEMBL201460 | N'-(5-tert-butyl-2-hydroxybenzylide...)
Show SMILES CC(C)(C)c1ccc(O)c(C=NNC(=O)c2ccccc2)c1 |w:10.9|
Show InChI InChI=1S/C18H20N2O2/c1-18(2,3)15-9-10-16(21)14(11-15)12-19-20-17(22)13-7-5-4-6-8-13/h4-12,21H,1-3H3,(H,20,22)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
Inhibition of 1-monooleoyl glycerol induced beta-hematin formation


Bioorg Med Chem Lett 16: 31-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.058
BindingDB Entry DOI: 10.7270/Q2K35VWT
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50176383
PNG
(CHEMBL200087 | N'-(5-tert-butyl-2-hydroxybenzylide...)
Show SMILES CC(C)(C)c1ccc(O)c(C=NNC(=O)c2ccc(Cl)cc2)c1 |w:10.9|
Show InChI InChI=1S/C18H19ClN2O2/c1-18(2,3)14-6-9-16(22)13(10-14)11-20-21-17(23)12-4-7-15(19)8-5-12/h4-11,22H,1-3H3,(H,21,23)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
Inhibition of 1-monooleoyl glycerol induced beta-hematin formation


Bioorg Med Chem Lett 16: 31-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.058
BindingDB Entry DOI: 10.7270/Q2K35VWT
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50176384
PNG
(2-hydroxy-5-bromobenzaldehyde 4-tert-butyl-benzoyl...)
Show SMILES CC(C)(C)c1ccc(cc1)C(=O)NN=Cc1cc(Br)ccc1O |w:14.15|
Show InChI InChI=1S/C18H19BrN2O2/c1-18(2,3)14-6-4-12(5-7-14)17(23)21-20-11-13-10-15(19)8-9-16(13)22/h4-11,22H,1-3H3,(H,21,23)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
Inhibition of 1-monooleoyl glycerol induced beta-hematin formation


Bioorg Med Chem Lett 16: 31-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.058
BindingDB Entry DOI: 10.7270/Q2K35VWT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%