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PubMed code 10464020

Compile data set for download or QSAR
Found 62 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
Integrase


(Human immunodeficiency virus 1)		BDBM50079932
PNG
(2,3-Dihydro-1,11-dithia-3a-aza-naphtho[2,3-f]azule...)
Show SMILES O=C1Sc2cc3ccccc3cc2C(=O)N2CCSC12
Show InChI InChI=1S/C15H11NO2S2/c17-13-11-7-9-3-1-2-4-10(9)8-12(11)20-15(18)14-16(13)5-6-19-14/h1-4,7-8,14H,5-6H2
PDB
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PubMed
n/an/a 4.00E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079932
PNG
(2,3-Dihydro-1,11-dithia-3a-aza-naphtho[2,3-f]azule...)
Show SMILES O=C1Sc2cc3ccccc3cc2C(=O)N2CCSC12
Show InChI InChI=1S/C15H11NO2S2/c17-13-11-7-9-3-1-2-4-10(9)8-12(11)20-15(18)14-16(13)5-6-19-14/h1-4,7-8,14H,5-6H2
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n/an/a 4.70E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079925
PNG
(6-Bromo-2,3-dihydro-1,9-dithia-3a-aza-benzo[f]azul...)
Show SMILES Brc1ccc2SC(=O)C3SCCN3C(=O)c2c1
Show InChI InChI=1S/C11H8BrNO2S2/c12-6-1-2-8-7(5-6)9(14)13-3-4-16-10(13)11(15)17-8/h1-2,5,10H,3-4H2
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n/an/a 4.80E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079928
PNG
(6-Methyl-1,10a-dihydro-2,9-dithia-3a-aza-benzo[f]a...)
Show SMILES Cc1ccc2SC(=O)C3CSCN3C(=O)c2c1
Show InChI InChI=1S/C12H11NO2S2/c1-7-2-3-10-8(4-7)11(14)13-6-16-5-9(13)12(15)17-10/h2-4,9H,5-6H2,1H3
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n/an/a 5.20E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079924
PNG
(6-Methyl-2,3-dihydro-1,9-dithia-3a-aza-benzo[f]azu...)
Show SMILES Cc1ccc2SC(=O)C3SCCN3C(=O)c2c1
Show InChI InChI=1S/C12H11NO2S2/c1-7-2-3-9-8(6-7)10(14)13-4-5-16-11(13)12(15)17-9/h2-3,6,11H,4-5H2,1H3
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n/an/a 5.50E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079925
PNG
(6-Bromo-2,3-dihydro-1,9-dithia-3a-aza-benzo[f]azul...)
Show SMILES Brc1ccc2SC(=O)C3SCCN3C(=O)c2c1
Show InChI InChI=1S/C11H8BrNO2S2/c12-6-1-2-8-7(5-6)9(14)13-3-4-16-10(13)11(15)17-8/h1-2,5,10H,3-4H2
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n/an/a 5.80E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079928
PNG
(6-Methyl-1,10a-dihydro-2,9-dithia-3a-aza-benzo[f]a...)
Show SMILES Cc1ccc2SC(=O)C3CSCN3C(=O)c2c1
Show InChI InChI=1S/C12H11NO2S2/c1-7-2-3-10-8(4-7)11(14)13-6-16-5-9(13)12(15)17-10/h2-4,9H,5-6H2,1H3
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n/an/a 6.30E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079924
PNG
(6-Methyl-2,3-dihydro-1,9-dithia-3a-aza-benzo[f]azu...)
Show SMILES Cc1ccc2SC(=O)C3SCCN3C(=O)c2c1
Show InChI InChI=1S/C12H11NO2S2/c1-7-2-3-9-8(6-7)10(14)13-4-5-16-11(13)12(15)17-9/h2-3,6,11H,4-5H2,1H3
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n/an/a 6.40E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079913
PNG
(6-Bromo-1,10a-dihydro-2,9-dithia-3a-aza-benzo[f]az...)
Show SMILES Brc1ccc2SC(=O)C3CSCN3C(=O)c2c1
Show InChI InChI=1S/C11H8BrNO2S2/c12-6-1-2-9-7(3-6)10(14)13-5-16-4-8(13)11(15)17-9/h1-3,8H,4-5H2
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n/an/a 7.40E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079926
PNG
(6-Methoxy-2-oxo-1,2,3,10a-tetrahydro-2lambda*4*,9-...)
Show SMILES COc1ccc2SC(=O)C3CS(=O)CN3C(=O)c2c1
Show InChI InChI=1S/C12H11NO4S2/c1-17-7-2-3-10-8(4-7)11(14)13-6-19(16)5-9(13)12(15)18-10/h2-4,9H,5-6H2,1H3
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n/an/a 8.45E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079913
PNG
(6-Bromo-1,10a-dihydro-2,9-dithia-3a-aza-benzo[f]az...)
Show SMILES Brc1ccc2SC(=O)C3CSCN3C(=O)c2c1
Show InChI InChI=1S/C11H8BrNO2S2/c12-6-1-2-9-7(3-6)10(14)13-5-16-4-8(13)11(15)17-9/h1-3,8H,4-5H2
PDB
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n/an/a 8.70E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079909
PNG
(7-Nitro-1,10a-dihydro-2,9-dithia-3a-aza-benzo[f]az...)
Show SMILES [O-][N+](=O)c1ccc2c(SC(=O)C3CSCN3C2=O)c1
Show InChI InChI=1S/C11H8N2O4S2/c14-10-7-2-1-6(13(16)17)3-9(7)19-11(15)8-4-18-5-12(8)10/h1-3,8H,4-5H2
PDB
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n/an/a 9.00E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079907
PNG
(1,12a-Dihydro-2,11-dithia-3a-aza-naphtho[2,3-f]azu...)
Show SMILES O=C1Sc2cc3ccccc3cc2C(=O)N2CSCC12
Show InChI InChI=1S/C15H11NO2S2/c17-14-11-5-9-3-1-2-4-10(9)6-13(11)20-15(18)12-7-19-8-16(12)14/h1-6,12H,7-8H2
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n/an/a 9.20E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079909
PNG
(7-Nitro-1,10a-dihydro-2,9-dithia-3a-aza-benzo[f]az...)
Show SMILES [O-][N+](=O)c1ccc2c(SC(=O)C3CSCN3C2=O)c1
Show InChI InChI=1S/C11H8N2O4S2/c14-10-7-2-1-6(13(16)17)3-9(7)19-11(15)8-4-18-5-12(8)10/h1-3,8H,4-5H2
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n/an/a 1.00E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079907
PNG
(1,12a-Dihydro-2,11-dithia-3a-aza-naphtho[2,3-f]azu...)
Show SMILES O=C1Sc2cc3ccccc3cc2C(=O)N2CSCC12
Show InChI InChI=1S/C15H11NO2S2/c17-14-11-5-9-3-1-2-4-10(9)6-13(11)20-15(18)12-7-19-8-16(12)14/h1-6,12H,7-8H2
PDB
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n/an/a 1.00E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079922
PNG
(2,3-Dihydro-1,9-dithia-3a-aza-benzo[f]azulene-4,10...)
Show SMILES O=C1Sc2ccccc2C(=O)N2CCSC12
Show InChI InChI=1S/C11H9NO2S2/c13-9-7-3-1-2-4-8(7)16-11(14)10-12(9)5-6-15-10/h1-4,10H,5-6H2
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n/an/a 1.10E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079911
PNG
(6-Chloro-2,3-dihydro-1,9-dithia-3a-aza-benzo[f]azu...)
Show SMILES Clc1ccc2SC(=O)C3SCCN3C(=O)c2c1
Show InChI InChI=1S/C11H8ClNO2S2/c12-6-1-2-8-7(5-6)9(14)13-3-4-16-10(13)11(15)17-8/h1-2,5,10H,3-4H2
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n/an/a 1.20E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079926
PNG
(6-Methoxy-2-oxo-1,2,3,10a-tetrahydro-2lambda*4*,9-...)
Show SMILES COc1ccc2SC(=O)C3CS(=O)CN3C(=O)c2c1
Show InChI InChI=1S/C12H11NO4S2/c1-17-7-2-3-10-8(4-7)11(14)13-6-19(16)5-9(13)12(15)18-10/h2-4,9H,5-6H2,1H3
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n/an/a 1.42E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079922
PNG
(2,3-Dihydro-1,9-dithia-3a-aza-benzo[f]azulene-4,10...)
Show SMILES O=C1Sc2ccccc2C(=O)N2CCSC12
Show InChI InChI=1S/C11H9NO2S2/c13-9-7-3-1-2-4-8(7)16-11(14)10-12(9)5-6-15-10/h1-4,10H,5-6H2
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n/an/a 1.46E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079911
PNG
(6-Chloro-2,3-dihydro-1,9-dithia-3a-aza-benzo[f]azu...)
Show SMILES Clc1ccc2SC(=O)C3SCCN3C(=O)c2c1
Show InChI InChI=1S/C11H8ClNO2S2/c12-6-1-2-8-7(5-6)9(14)13-3-4-16-10(13)11(15)17-8/h1-2,5,10H,3-4H2
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n/an/a 1.51E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079914
PNG
(6-Methoxy-1,10a-dihydro-2,9-dithia-3a-aza-benzo[f]...)
Show SMILES COc1ccc2SC(=O)C3CSCN3C(=O)c2c1
Show InChI InChI=1S/C12H11NO3S2/c1-16-7-2-3-10-8(4-7)11(14)13-6-17-5-9(13)12(15)18-10/h2-4,9H,5-6H2,1H3
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n/an/a 1.55E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079914
PNG
(6-Methoxy-1,10a-dihydro-2,9-dithia-3a-aza-benzo[f]...)
Show SMILES COc1ccc2SC(=O)C3CSCN3C(=O)c2c1
Show InChI InChI=1S/C12H11NO3S2/c1-16-7-2-3-10-8(4-7)11(14)13-6-17-5-9(13)12(15)18-10/h2-4,9H,5-6H2,1H3
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n/an/a 1.55E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079908
PNG
(6-Chloro-1,10a-dihydro-2,9-dithia-3a-aza-benzo[f]a...)
Show SMILES Clc1ccc2SC(=O)C3CSCN3C(=O)c2c1
Show InChI InChI=1S/C11H8ClNO2S2/c12-6-1-2-9-7(3-6)10(14)13-5-16-4-8(13)11(15)17-9/h1-3,8H,4-5H2
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n/an/a 1.58E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079908
PNG
(6-Chloro-1,10a-dihydro-2,9-dithia-3a-aza-benzo[f]a...)
Show SMILES Clc1ccc2SC(=O)C3CSCN3C(=O)c2c1
Show InChI InChI=1S/C11H8ClNO2S2/c12-6-1-2-9-7(3-6)10(14)13-5-16-4-8(13)11(15)17-9/h1-3,8H,4-5H2
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n/an/a 1.60E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079933
PNG
(2-Oxo-1,2,3,10a-tetrahydro-2lambda*4*,9-dithia-3a-...)
Show SMILES O=C1Sc2ccccc2C(=O)N2CS(=O)CC12
Show InChI InChI=1S/C11H9NO3S2/c13-10-7-3-1-2-4-9(7)16-11(14)8-5-17(15)6-12(8)10/h1-4,8H,5-6H2
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n/an/a 2.00E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079912
PNG
(1,10a-Dihydro-2,9-dithia-3a-aza-benzo[f]azulene-4,...)
Show SMILES O=C1Sc2ccccc2C(=O)N2CSCC12
Show InChI InChI=1S/C11H9NO2S2/c13-10-7-3-1-2-4-9(7)16-11(14)8-5-15-6-12(8)10/h1-4,8H,5-6H2
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n/an/a 2.08E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079933
PNG
(2-Oxo-1,2,3,10a-tetrahydro-2lambda*4*,9-dithia-3a-...)
Show SMILES O=C1Sc2ccccc2C(=O)N2CS(=O)CC12
Show InChI InChI=1S/C11H9NO3S2/c13-10-7-3-1-2-4-9(7)16-11(14)8-5-17(15)6-12(8)10/h1-4,8H,5-6H2
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n/an/a 2.15E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079912
PNG
(1,10a-Dihydro-2,9-dithia-3a-aza-benzo[f]azulene-4,...)
Show SMILES O=C1Sc2ccccc2C(=O)N2CSCC12
Show InChI InChI=1S/C11H9NO2S2/c13-10-7-3-1-2-4-9(7)16-11(14)8-5-15-6-12(8)10/h1-4,8H,5-6H2
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n/an/a 2.27E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079919
PNG
(6-Chloro-2-oxo-1,2,3,10a-tetrahydro-2lambda*4*,9-d...)
Show SMILES Clc1ccc2SC(=O)C3CS(=O)CN3C(=O)c2c1
Show InChI InChI=1S/C11H8ClNO3S2/c12-6-1-2-9-7(3-6)10(14)13-5-18(16)4-8(13)11(15)17-9/h1-3,8H,4-5H2
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n/an/a 2.60E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079919
PNG
(6-Chloro-2-oxo-1,2,3,10a-tetrahydro-2lambda*4*,9-d...)
Show SMILES Clc1ccc2SC(=O)C3CS(=O)CN3C(=O)c2c1
Show InChI InChI=1S/C11H8ClNO3S2/c12-6-1-2-9-7(3-6)10(14)13-5-18(16)4-8(13)11(15)17-9/h1-3,8H,4-5H2
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n/an/a 2.80E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079927
PNG
(4H-9-Thia-3a-aza-benzo[f]azulen-10-one | CHEMBL113...)
Show SMILES O=C1Sc2ccccc2Cn2cccc12
Show InChI InChI=1S/C12H9NOS/c14-12-10-5-3-7-13(10)8-9-4-1-2-6-11(9)15-12/h1-7H,8H2
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n/an/a 3.00E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079915
PNG
(1,10a-Dihydro-2-oxa-9-thia-3a-aza-benzo[f]azulene-...)
Show SMILES O=C1Sc2ccccc2C(=O)N2COCC12
Show InChI InChI=1S/C11H9NO3S/c13-10-7-3-1-2-4-9(7)16-11(14)8-5-15-6-12(8)10/h1-4,8H,5-6H2
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n/an/a>3.33E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079923
PNG
(12,13-dimethoxy-5,9-dithia-3- azatricyclo[8.4.0.0³...)
Show SMILES COc1cc2SC(=O)C3CSCN3C(=O)c2cc1OC
Show InChI InChI=1S/C13H13NO4S2/c1-17-9-3-7-11(4-10(9)18-2)20-13(16)8-5-19-6-14(8)12(7)15/h3-4,8H,5-6H2,1-2H3
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n/an/a 3.33E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079915
PNG
(1,10a-Dihydro-2-oxa-9-thia-3a-aza-benzo[f]azulene-...)
Show SMILES O=C1Sc2ccccc2C(=O)N2COCC12
Show InChI InChI=1S/C11H9NO3S/c13-10-7-3-1-2-4-9(7)16-11(14)8-5-15-6-12(8)10/h1-4,8H,5-6H2
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n/an/a>3.33E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079905
PNG
(1,3,4,11a-Tetrahydro-2H-10-thia-4a-aza-dibenzo[a,d...)
Show SMILES O=C1Sc2ccccc2C(=O)N2CCCCC12
Show InChI InChI=1S/C13H13NO2S/c15-12-9-5-1-2-7-11(9)17-13(16)10-6-3-4-8-14(10)12/h1-2,5,7,10H,3-4,6,8H2
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n/an/a 3.43E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079917
PNG
(3-Phenyl-10,10a-dihydro-1H-2,9-dithia-3a-aza-benzo...)
Show SMILES O=C1N2C(CSC2c2ccccc2)CSc2ccccc12
Show InChI InChI=1S/C17H15NOS2/c19-16-14-8-4-5-9-15(14)20-10-13-11-21-17(18(13)16)12-6-2-1-3-7-12/h1-9,13,17H,10-11H2
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n/an/a 3.72E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079917
PNG
(3-Phenyl-10,10a-dihydro-1H-2,9-dithia-3a-aza-benzo...)
Show SMILES O=C1N2C(CSC2c2ccccc2)CSc2ccccc12
Show InChI InChI=1S/C17H15NOS2/c19-16-14-8-4-5-9-15(14)20-10-13-11-21-17(18(13)16)12-6-2-1-3-7-12/h1-9,13,17H,10-11H2
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n/an/a 3.76E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079905
PNG
(1,3,4,11a-Tetrahydro-2H-10-thia-4a-aza-dibenzo[a,d...)
Show SMILES O=C1Sc2ccccc2C(=O)N2CCCCC12
Show InChI InChI=1S/C13H13NO2S/c15-12-9-5-1-2-7-11(9)17-13(16)10-6-3-4-8-14(10)12/h1-2,5,7,10H,3-4,6,8H2
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n/an/a 4.06E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079921
PNG
(6-Methyl-1-oxo-1,2,3,10a-tetrahydro-1lambda*4*,9-d...)
Show SMILES Cc1ccc2SC(=O)C3N(CCS3=O)C(=O)c2c1
Show InChI InChI=1S/C12H11NO3S2/c1-7-2-3-9-8(6-7)10(14)13-4-5-18(16)11(13)12(15)17-9/h2-3,6,11H,4-5H2,1H3
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n/an/a 5.90E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079921
PNG
(6-Methyl-1-oxo-1,2,3,10a-tetrahydro-1lambda*4*,9-d...)
Show SMILES Cc1ccc2SC(=O)C3N(CCS3=O)C(=O)c2c1
Show InChI InChI=1S/C12H11NO3S2/c1-7-2-3-9-8(6-7)10(14)13-4-5-18(16)11(13)12(15)17-9/h2-3,6,11H,4-5H2,1H3
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n/an/a 5.90E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079927
PNG
(4H-9-Thia-3a-aza-benzo[f]azulen-10-one | CHEMBL113...)
Show SMILES O=C1Sc2ccccc2Cn2cccc12
Show InChI InChI=1S/C12H9NOS/c14-12-10-5-3-7-13(10)8-9-4-1-2-6-11(9)15-12/h1-7H,8H2
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n/an/a 5.90E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079923
PNG
(12,13-dimethoxy-5,9-dithia-3- azatricyclo[8.4.0.0³...)
Show SMILES COc1cc2SC(=O)C3CSCN3C(=O)c2cc1OC
Show InChI InChI=1S/C13H13NO4S2/c1-17-9-3-7-11(4-10(9)18-2)20-13(16)8-5-19-6-14(8)12(7)15/h3-4,8H,5-6H2,1-2H3
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n/an/a 6.70E+5n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079929
PNG
(3-(4-Methyl-piperazin-1-ylmethyl)-10-phenyl-4H,10H...)
Show SMILES CN1CCN(Cc2ccc3C(Sc4ccccc4Cn23)c2ccccc2)CC1
Show InChI InChI=1S/C24H27N3S/c1-25-13-15-26(16-14-25)18-21-11-12-22-24(19-7-3-2-4-8-19)28-23-10-6-5-9-20(23)17-27(21)22/h2-12,24H,13-18H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079931
PNG
(6,7-Dimethoxy-2,3,10,10a-tetrahydro-1H-9-thia-3a-a...)
Show SMILES COc1cc2SCC3CCCN3C(=O)c2cc1OC
Show InChI InChI=1S/C14H17NO3S/c1-17-11-6-10-13(7-12(11)18-2)19-8-9-4-3-5-15(9)14(10)16/h6-7,9H,3-5,8H2,1-2H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079918
PNG
(10-Hydroxy-2,3,10,10a-tetrahydro-1H-9-thia-3a-aza-...)
Show SMILES OC1Sc2ccccc2C(=O)N2CCCC12
Show InChI InChI=1S/C12H13NO2S/c14-11-8-4-1-2-6-10(8)16-12(15)9-5-3-7-13(9)11/h1-2,4,6,9,12,15H,3,5,7H2
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079934
PNG
(CHEMBL32804 | [10-(4-Fluoro-phenyl)-4H,10H-9-thia-...)
Show SMILES CN(C)Cc1ccc2C(Sc3ccccc3Cn12)c1ccc(F)cc1
Show InChI InChI=1S/C21H21FN2S/c1-23(2)14-18-11-12-19-21(15-7-9-17(22)10-8-15)25-20-6-4-3-5-16(20)13-24(18)19/h3-12,21H,13-14H2,1-2H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079906
PNG
(10-Hydroxy-10-phenyl-2,3,10,10a-tetrahydro-1H-9-th...)
Show SMILES OC1(Sc2ccccc2C(=O)N2CCCC12)c1ccccc1
Show InChI InChI=1S/C18H17NO2S/c20-17-14-9-4-5-10-15(14)22-18(21,13-7-2-1-3-8-13)16-11-6-12-19(16)17/h1-5,7-10,16,21H,6,11-12H2
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079920
PNG
(10-(4-Methyl-piperazin-1-yl)-2,3,10,10a-tetrahydro...)
Show SMILES CN1CCN(CC1)C1Sc2ccccc2C(=O)N2CCCC12
Show InChI InChI=1S/C17H23N3OS/c1-18-9-11-19(12-10-18)17-14-6-4-8-20(14)16(21)13-5-2-3-7-15(13)22-17/h2-3,5,7,14,17H,4,6,8-12H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079930
PNG
(10-Methoxy-2,3,10,10a-tetrahydro-1H-9-thia-3a-aza-...)
Show SMILES COC1Sc2ccccc2C(=O)N2CCCC12
Show InChI InChI=1S/C13H15NO2S/c1-16-13-10-6-4-8-14(10)12(15)9-5-2-3-7-11(9)17-13/h2-3,5,7,10,13H,4,6,8H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079916
PNG
(6,7-Dimethoxy-1,2,3,10a-tetrahydro-9-thia-3a-aza-b...)
Show SMILES COc1cc2SC(=O)C3CCCN3C(=O)c2cc1OC
Show InChI InChI=1S/C14H15NO4S/c1-18-10-6-8-12(7-11(10)19-2)20-14(17)9-4-3-5-15(9)13(8)16/h6-7,9H,3-5H2,1-2H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079931
PNG
(6,7-Dimethoxy-2,3,10,10a-tetrahydro-1H-9-thia-3a-a...)
Show SMILES COc1cc2SCC3CCCN3C(=O)c2cc1OC
Show InChI InChI=1S/C14H17NO3S/c1-17-11-6-10-13(7-12(11)18-2)19-8-9-4-3-5-15(9)14(10)16/h6-7,9H,3-5,8H2,1-2H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079935
PNG
(4H,10H-9-Thia-3a-aza-benzo[f]azulene-10-carboxylic...)
Show SMILES CCOC(=O)C1Sc2ccccc2Cn2cccc12
Show InChI InChI=1S/C15H15NO2S/c1-2-18-15(17)14-12-7-5-9-16(12)10-11-6-3-4-8-13(11)19-14/h3-9,14H,2,10H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079929
PNG
(3-(4-Methyl-piperazin-1-ylmethyl)-10-phenyl-4H,10H...)
Show SMILES CN1CCN(Cc2ccc3C(Sc4ccccc4Cn23)c2ccccc2)CC1
Show InChI InChI=1S/C24H27N3S/c1-25-13-15-26(16-14-25)18-21-11-12-22-24(19-7-3-2-4-8-19)28-23-10-6-5-9-20(23)17-27(21)22/h2-12,24H,13-18H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079930
PNG
(10-Methoxy-2,3,10,10a-tetrahydro-1H-9-thia-3a-aza-...)
Show SMILES COC1Sc2ccccc2C(=O)N2CCCC12
Show InChI InChI=1S/C13H15NO2S/c1-16-13-10-6-4-8-14(10)12(15)9-5-2-3-7-11(9)17-13/h2-3,5,7,10,13H,4,6,8H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079918
PNG
(10-Hydroxy-2,3,10,10a-tetrahydro-1H-9-thia-3a-aza-...)
Show SMILES OC1Sc2ccccc2C(=O)N2CCCC12
Show InChI InChI=1S/C12H13NO2S/c14-11-8-4-1-2-6-10(8)16-12(15)9-5-3-7-13(9)11/h1-2,4,6,9,12,15H,3,5,7H2
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079910
PNG
(Acetic acid 4-oxo-2,3,10,10a-tetrahydro-1H,4H-9-th...)
Show SMILES CC(=O)OC1Sc2ccccc2C(=O)N2CCCC12
Show InChI InChI=1S/C14H15NO3S/c1-9(16)18-14-11-6-4-8-15(11)13(17)10-5-2-3-7-12(10)19-14/h2-3,5,7,11,14H,4,6,8H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079920
PNG
(10-(4-Methyl-piperazin-1-yl)-2,3,10,10a-tetrahydro...)
Show SMILES CN1CCN(CC1)C1Sc2ccccc2C(=O)N2CCCC12
Show InChI InChI=1S/C17H23N3OS/c1-18-9-11-19(12-10-18)17-14-6-4-8-20(14)16(21)13-5-2-3-7-15(13)22-17/h2-3,5,7,14,17H,4,6,8-12H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079910
PNG
(Acetic acid 4-oxo-2,3,10,10a-tetrahydro-1H,4H-9-th...)
Show SMILES CC(=O)OC1Sc2ccccc2C(=O)N2CCCC12
Show InChI InChI=1S/C14H15NO3S/c1-9(16)18-14-11-6-4-8-15(11)13(17)10-5-2-3-7-12(10)19-14/h2-3,5,7,11,14H,4,6,8H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079916
PNG
(6,7-Dimethoxy-1,2,3,10a-tetrahydro-9-thia-3a-aza-b...)
Show SMILES COc1cc2SC(=O)C3CCCN3C(=O)c2cc1OC
Show InChI InChI=1S/C14H15NO4S/c1-18-10-6-8-12(7-11(10)19-2)20-14(17)9-4-3-5-15(9)13(8)16/h6-7,9H,3-5H2,1-2H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079906
PNG
(10-Hydroxy-10-phenyl-2,3,10,10a-tetrahydro-1H-9-th...)
Show SMILES OC1(Sc2ccccc2C(=O)N2CCCC12)c1ccccc1
Show InChI InChI=1S/C18H17NO2S/c20-17-14-9-4-5-10-15(14)22-18(21,13-7-2-1-3-8-13)16-11-6-12-19(16)17/h1-5,7-10,16,21H,6,11-12H2
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079934
PNG
(CHEMBL32804 | [10-(4-Fluoro-phenyl)-4H,10H-9-thia-...)
Show SMILES CN(C)Cc1ccc2C(Sc3ccccc3Cn12)c1ccc(F)cc1
Show InChI InChI=1S/C21H21FN2S/c1-23(2)14-18-11-12-19-21(15-7-9-17(22)10-8-15)25-20-6-4-3-5-16(20)13-24(18)19/h3-12,21H,13-14H2,1-2H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-end joining activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)		BDBM50079935
PNG
(4H,10H-9-Thia-3a-aza-benzo[f]azulene-10-carboxylic...)
Show SMILES CCOC(=O)C1Sc2ccccc2Cn2cccc12
Show InChI InChI=1S/C15H15NO2S/c1-2-18-15(17)14-12-7-5-9-16(12)10-11-6-3-4-8-13(11)19-14/h3-9,14H,2,10H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of the 3'-processing activity of HIV-1 integrase

J Med Chem 42: 3334-41 (1999)


Article DOI: 10.1021/jm990047z
BindingDB Entry DOI: 10.7270/Q21835Q9
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%