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PubMed code 8568831

Compile data set for download or QSAR
Found 42 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
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9618
PNG
((S)-N-(1S,2R)-[3-[2-[[1,1-Dimethylethyl)amino]carb...)
Show SMILES CC(=O)N[C@H](CS(=O)c1ccc2ccccc2n1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C35H40N4O5S/c1-23(40)36-30(22-45(44)32-19-18-25-14-9-11-17-28(25)37-32)34(43)38-29(20-24-12-6-5-7-13-24)31(41)21-26-15-8-10-16-27(26)33(42)39-35(2,3)4/h5-19,29-31,41H,20-22H2,1-4H3,(H,36,40)(H,38,43)(H,39,42)/t29-,30+,31+,45?/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9619
PNG
(D-Cysteine Analog 15b | N-tert-butyl-2-[(2R,3S)-3-...)
Show SMILES CC(=O)N[C@H](CS(=O)(=O)c1ccc2ccccc2n1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C35H40N4O6S/c1-23(40)36-30(22-46(44,45)32-19-18-25-14-9-11-17-28(25)37-32)34(43)38-29(20-24-12-6-5-7-13-24)31(41)21-26-15-8-10-16-27(26)33(42)39-35(2,3)4/h5-19,29-31,41H,20-22H2,1-4H3,(H,36,40)(H,38,43)(H,39,42)/t29-,30+,31+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9641
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)(=O)c1ccc2ccccc2c1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C35H41N3O7S2/c1-35(2,3)37-33(40)29-17-11-10-16-27(29)22-32(39)30(20-24-12-6-5-7-13-24)36-34(41)31(38-46(4,42)43)23-47(44,45)28-19-18-25-14-8-9-15-26(25)21-28/h5-19,21,30-32,38-39H,20,22-23H2,1-4H3,(H,36,41)(H,37,40)/t30-,31+,32+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9620
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(=O)N[C@H](CS(=O)(=O)c1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C36H41N3O6S/c1-24(40)37-32(23-46(44,45)29-19-18-26-14-8-9-15-27(26)21-29)35(43)38-31(20-25-12-6-5-7-13-25)33(41)22-28-16-10-11-17-30(28)34(42)39-36(2,3)4/h5-19,21,31-33,41H,20,22-23H2,1-4H3,(H,37,40)(H,38,43)(H,39,42)/t31-,32+,33+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9648
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)(=O)c1ccc(Cl)cc1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C31H38ClN3O7S2/c1-31(2,3)34-29(37)25-13-9-8-12-22(25)19-28(36)26(18-21-10-6-5-7-11-21)33-30(38)27(35-43(4,39)40)20-44(41,42)24-16-14-23(32)15-17-24/h5-17,26-28,35-36H,18-20H2,1-4H3,(H,33,38)(H,34,37)/t26-,27+,28+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9636
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)c1ccc(F)cc1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C31H38FN3O6S2/c1-31(2,3)34-29(37)25-13-9-8-12-22(25)19-28(36)26(18-21-10-6-5-7-11-21)33-30(38)27(35-43(4,40)41)20-42(39)24-16-14-23(32)15-17-24/h5-17,26-28,35-36H,18-20H2,1-4H3,(H,33,38)(H,34,37)/t26-,27+,28+,42?/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9643
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)(=O)c1cccc2ccccc12)NS(C)(=O)=O |r|
Show InChI InChI=1S/C35H41N3O7S2/c1-35(2,3)37-33(40)28-19-11-9-16-26(28)22-31(39)29(21-24-13-6-5-7-14-24)36-34(41)30(38-46(4,42)43)23-47(44,45)32-20-12-17-25-15-8-10-18-27(25)32/h5-20,29-31,38-39H,21-23H2,1-4H3,(H,36,41)(H,37,40)/t29-,30+,31+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9634
PNG
((S)-N-(1S,2R)-[3-[2-[[1,1-Dimethylethyl)amino]carb...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)c1cccc2ccccc12)NS(C)(=O)=O |r|
Show InChI InChI=1S/C35H41N3O6S2/c1-35(2,3)37-33(40)28-19-11-9-16-26(28)22-31(39)29(21-24-13-6-5-7-14-24)36-34(41)30(38-46(4,43)44)23-45(42)32-20-12-17-25-15-8-10-18-27(25)32/h5-20,29-31,38-39H,21-23H2,1-4H3,(H,36,41)(H,37,40)/t29-,30+,31+,45?/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9645
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)(=O)c1ccc(F)cc1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C31H38FN3O7S2/c1-31(2,3)34-29(37)25-13-9-8-12-22(25)19-28(36)26(18-21-10-6-5-7-11-21)33-30(38)27(35-43(4,39)40)20-44(41,42)24-16-14-23(32)15-17-24/h5-17,26-28,35-36H,18-20H2,1-4H3,(H,33,38)(H,34,37)/t26-,27+,28+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9626
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CSc1cccc2ccccc12)NS(C)(=O)=O |r|
Show InChI InChI=1S/C35H41N3O5S2/c1-35(2,3)37-33(40)28-19-11-9-16-26(28)22-31(39)29(21-24-13-6-5-7-14-24)36-34(41)30(38-45(4,42)43)23-44-32-20-12-17-25-15-8-10-18-27(25)32/h5-20,29-31,38-39H,21-23H2,1-4H3,(H,36,41)(H,37,40)/t29-,30+,31+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9624
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CSc1ccc2ccccc2c1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C35H41N3O5S2/c1-35(2,3)37-33(40)29-17-11-10-16-27(29)22-32(39)30(20-24-12-6-5-7-13-24)36-34(41)31(38-45(4,42)43)23-44-28-19-18-25-14-8-9-15-26(25)21-28/h5-19,21,30-32,38-39H,20,22-23H2,1-4H3,(H,36,41)(H,37,40)/t30-,31+,32+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9633
PNG
((S)-N-(1S,2R)-[3-[2-[[1,1-Dimethylethyl)amino]carb...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)c1ccccc1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C31H39N3O6S2/c1-31(2,3)33-29(36)25-18-12-11-15-23(25)20-28(35)26(19-22-13-7-5-8-14-22)32-30(37)27(34-42(4,39)40)21-41(38)24-16-9-6-10-17-24/h5-18,26-28,34-35H,19-21H2,1-4H3,(H,32,37)(H,33,36)/t26-,27+,28+,41?/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9646
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)(=O)c1ccc(cc1)C(F)(F)F)NS(C)(=O)=O |r|
Show InChI InChI=1S/C32H38F3N3O7S2/c1-31(2,3)37-29(40)25-13-9-8-12-22(25)19-28(39)26(18-21-10-6-5-7-11-21)36-30(41)27(38-46(4,42)43)20-47(44,45)24-16-14-23(15-17-24)32(33,34)35/h5-17,26-28,38-39H,18-20H2,1-4H3,(H,36,41)(H,37,40)/t26-,27+,28+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9638
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES Cn1nnnc1S(=O)C[C@@H](NS(C)(=O)=O)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C27H37N7O6S2/c1-27(2,3)29-24(36)20-14-10-9-13-19(20)16-23(35)21(15-18-11-7-6-8-12-18)28-25(37)22(31-42(5,39)40)17-41(38)26-30-32-33-34(26)4/h6-14,21-23,31,35H,15-17H2,1-5H3,(H,28,37)(H,29,36)/t21-,22+,23+,41?/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9637
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)c1ccc(cc1)C(F)(F)F)NS(C)(=O)=O |r|
Show InChI InChI=1S/C32H38F3N3O6S2/c1-31(2,3)37-29(40)25-13-9-8-12-22(25)19-28(39)26(18-21-10-6-5-7-11-21)36-30(41)27(38-46(4,43)44)20-45(42)24-16-14-23(15-17-24)32(33,34)35/h5-17,26-28,38-39H,18-20H2,1-4H3,(H,36,41)(H,37,40)/t26-,27+,28+,45?/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9647
PNG
(D-Cysteine Analog 18j | N-tert-butyl-2-[(2R,3S)-2-...)
Show SMILES COc1ccc(cc1)S(=O)(=O)C[C@@H](NS(C)(=O)=O)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C32H41N3O8S2/c1-32(2,3)34-30(37)26-14-10-9-13-23(26)20-29(36)27(19-22-11-7-6-8-12-22)33-31(38)28(35-44(5,39)40)21-45(41,42)25-17-15-24(43-4)16-18-25/h6-18,27-29,35-36H,19-21H2,1-5H3,(H,33,38)(H,34,37)/t27-,28+,29+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9640
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)(=O)c1ccc2ccccc2n1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C34H40N4O7S2/c1-34(2,3)37-32(40)26-16-10-8-15-25(26)21-30(39)28(20-23-12-6-5-7-13-23)36-33(41)29(38-46(4,42)43)22-47(44,45)31-19-18-24-14-9-11-17-27(24)35-31/h5-19,28-30,38-39H,20-22H2,1-4H3,(H,36,41)(H,37,40)/t28-,29+,30+/m0/s1
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n/an/a 2.80n/an/an/an/an/an/a



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9632
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)c1ccc2ccccc2c1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C35H41N3O6S2/c1-35(2,3)37-33(40)29-17-11-10-16-27(29)22-32(39)30(20-24-12-6-5-7-13-24)36-34(41)31(38-46(4,43)44)23-45(42)28-19-18-25-14-8-9-15-26(25)21-28/h5-19,21,30-32,38-39H,20,22-23H2,1-4H3,(H,36,41)(H,37,40)/t30-,31+,32+,45?/m0/s1
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n/an/a 3.5n/an/an/an/an/an/a



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9628
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CSc1ccc(F)cc1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C31H38FN3O5S2/c1-31(2,3)34-29(37)25-13-9-8-12-22(25)19-28(36)26(18-21-10-6-5-7-11-21)33-30(38)27(35-42(4,39)40)20-41-24-16-14-23(32)15-17-24/h5-17,26-28,35-36H,18-20H2,1-4H3,(H,33,38)(H,34,37)/t26-,27+,28+/m0/s1
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n/an/a 4.40n/an/an/an/an/an/a



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9613
PNG
((R)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)-amino]ca...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(=O)OCc1ccccc1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C33H41N3O7S/c1-33(2,3)35-31(39)26-18-12-11-17-25(26)20-29(37)27(19-23-13-7-5-8-14-23)34-32(40)28(36-44(4,41)42)21-30(38)43-22-24-15-9-6-10-16-24/h5-18,27-29,36-37H,19-22H2,1-4H3,(H,34,40)(H,35,39)/t27-,28+,29+/m0/s1
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n/an/a 5.40n/an/an/an/a5.537



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9642
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)(=O)c1ccccc1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C31H39N3O7S2/c1-31(2,3)33-29(36)25-18-12-11-15-23(25)20-28(35)26(19-22-13-7-5-8-14-22)32-30(37)27(34-42(4,38)39)21-43(40,41)24-16-9-6-10-17-24/h5-18,26-28,34-35H,19-21H2,1-4H3,(H,32,37)(H,33,36)/t26-,27+,28+/m0/s1
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n/an/a 5.70n/an/an/an/an/an/a



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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9635
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)c1ccccn1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C30H38N4O6S2/c1-30(2,3)33-28(36)23-15-9-8-14-22(23)19-26(35)24(18-21-12-6-5-7-13-21)32-29(37)25(34-42(4,39)40)20-41(38)27-16-10-11-17-31-27/h5-17,24-26,34-35H,18-20H2,1-4H3,(H,32,37)(H,33,36)/t24-,25+,26+,41?/m0/s1
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n/an/a 7.90n/an/an/an/an/an/a



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9615
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(=O)N[C@H](CSc1ccc2ccccc2n1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C35H40N4O4S/c1-23(40)36-30(22-44-32-19-18-25-14-9-11-17-28(25)37-32)34(43)38-29(20-24-12-6-5-7-13-24)31(41)21-26-15-8-10-16-27(26)33(42)39-35(2,3)4/h5-19,29-31,41H,20-22H2,1-4H3,(H,36,40)(H,38,43)(H,39,42)/t29-,30+,31+/m0/s1
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n/an/a 14.7n/an/an/an/a5.537



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9622
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CSCc1ccccc1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C32H41N3O5S2/c1-32(2,3)34-30(37)26-18-12-11-17-25(26)20-29(36)27(19-23-13-7-5-8-14-23)33-31(38)28(35-42(4,39)40)22-41-21-24-15-9-6-10-16-24/h5-18,27-29,35-36H,19-22H2,1-4H3,(H,33,38)(H,34,37)/t27-,28+,29+/m0/s1
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n/an/a 14.7n/an/an/an/an/an/a



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9631
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES COc1ccc(SC[C@@H](NS(C)(=O)=O)C(=O)N[C@@H](Cc2ccccc2)[C@H](O)Cc2ccccc2C(=O)NC(C)(C)C)cc1 |r|
Show InChI InChI=1S/C32H41N3O6S2/c1-32(2,3)34-30(37)26-14-10-9-13-23(26)20-29(36)27(19-22-11-7-6-8-12-22)33-31(38)28(35-43(5,39)40)21-42-25-17-15-24(41-4)16-18-25/h6-18,27-29,35-36H,19-21H2,1-5H3,(H,33,38)(H,34,37)/t27-,28+,29+/m0/s1
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n/an/a 16n/an/an/an/an/an/a



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9630
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES Cn1nnnc1SC[C@@H](NS(C)(=O)=O)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C27H37N7O5S2/c1-27(2,3)29-24(36)20-14-10-9-13-19(20)16-23(35)21(15-18-11-7-6-8-12-18)28-25(37)22(31-41(5,38)39)17-40-26-30-32-33-34(26)4/h6-14,21-23,31,35H,15-17H2,1-5H3,(H,28,37)(H,29,36)/t21-,22+,23+/m0/s1
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n/an/a 17.5n/an/an/an/an/an/a



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9639
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)(=O)Cc1ccccc1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C32H41N3O7S2/c1-32(2,3)34-30(37)26-18-12-11-17-25(26)20-29(36)27(19-23-13-7-5-8-14-23)33-31(38)28(35-43(4,39)40)22-44(41,42)21-24-15-9-6-10-16-24/h5-18,27-29,35-36H,19-22H2,1-4H3,(H,33,38)(H,34,37)/t27-,28+,29+/m0/s1
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n/an/a 19.4n/an/an/an/an/an/a



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9621
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(=O)N[C@H](CS(=O)(=O)c1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C32H39N3O6S/c1-22(36)33-28(21-42(40,41)25-16-9-6-10-17-25)31(39)34-27(19-23-13-7-5-8-14-23)29(37)20-24-15-11-12-18-26(24)30(38)35-32(2,3)4/h5-18,27-29,37H,19-21H2,1-4H3,(H,33,36)(H,34,39)(H,35,38)/t27-,28+,29+/m0/s1
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n/an/a 20n/an/an/an/an/an/a



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9644
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CS(=O)(=O)c1ccccn1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C30H38N4O7S2/c1-30(2,3)33-28(36)23-15-9-8-14-22(23)19-26(35)24(18-21-12-6-5-7-13-21)32-29(37)25(34-42(4,38)39)20-43(40,41)27-16-10-11-17-31-27/h5-17,24-26,34-35H,18-20H2,1-4H3,(H,32,37)(H,33,36)/t24-,25+,26+/m0/s1
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n/an/a 22n/an/an/an/an/an/a



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9616
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(=O)N[C@H](CSc1ccc2ccccc2c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C36H41N3O4S/c1-24(40)37-32(23-44-29-19-18-26-14-8-9-15-27(26)21-29)35(43)38-31(20-25-12-6-5-7-13-25)33(41)22-28-16-10-11-17-30(28)34(42)39-36(2,3)4/h5-19,21,31-33,41H,20,22-23H2,1-4H3,(H,37,40)(H,38,43)(H,39,42)/t31-,32+,33+/m0/s1
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n/an/a 42n/an/an/an/a5.537



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9625
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CSc1ccccc1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C31H39N3O5S2/c1-31(2,3)33-29(36)25-18-12-11-15-23(25)20-28(35)26(19-22-13-7-5-8-14-22)32-30(37)27(34-41(4,38)39)21-40-24-16-9-6-10-17-24/h5-18,26-28,34-35H,19-21H2,1-4H3,(H,32,37)(H,33,36)/t26-,27+,28+/m0/s1
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n/an/a 44n/an/an/an/an/an/a



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9614
PNG
(2-[(2R,3S)-3-[(2S)-3-(benzylsulfanyl)-2-acetamidop...)
Show SMILES CC(=O)N[C@H](CSCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C33H41N3O4S/c1-23(37)34-29(22-41-21-25-15-9-6-10-16-25)32(40)35-28(19-24-13-7-5-8-14-24)30(38)20-26-17-11-12-18-27(26)31(39)36-33(2,3)4/h5-18,28-30,38H,19-22H2,1-4H3,(H,34,37)(H,35,40)(H,36,39)/t28-,29+,30+/m0/s1
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n/an/a 45n/an/an/an/a5.537



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9612
PNG
((R)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)-amino]ca...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(=O)OCc1ccccc1)NC(N)=O |r|
Show InChI InChI=1S/C33H40N4O6/c1-33(2,3)37-30(40)25-17-11-10-16-24(25)19-28(38)26(18-22-12-6-4-7-13-22)35-31(41)27(36-32(34)42)20-29(39)43-21-23-14-8-5-9-15-23/h4-17,26-28,38H,18-21H2,1-3H3,(H,35,41)(H,37,40)(H3,34,36,42)/t26-,27+,28+/m0/s1
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n/an/a 51n/an/an/an/a5.537



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9623
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CSc1ccc2ccccc2n1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C34H40N4O5S2/c1-34(2,3)37-32(40)26-16-10-8-15-25(26)21-30(39)28(20-23-12-6-5-7-13-23)36-33(41)29(38-45(4,42)43)22-44-31-19-18-24-14-9-11-17-27(24)35-31/h5-19,28-30,38-39H,20-22H2,1-4H3,(H,36,41)(H,37,40)/t28-,29+,30+/m0/s1
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n/an/a 60n/an/an/an/an/an/a



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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9610
PNG
((R)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)-amino]ca...)
Show SMILES CCC(=O)N[C@H](CC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C35H43N3O6/c1-5-31(40)36-29(22-32(41)44-23-25-16-10-7-11-17-25)34(43)37-28(20-24-14-8-6-9-15-24)30(39)21-26-18-12-13-19-27(26)33(42)38-35(2,3)4/h6-19,28-30,39H,5,20-23H2,1-4H3,(H,36,40)(H,37,43)(H,38,42)/t28-,29+,30+/m0/s1
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n/an/a 73n/an/an/an/a5.537



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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9609
PNG
((R)-N-(1S,2R)-[3-[2-[[1,1-Dimethylethyl)amino]carb...)
Show SMILES CC(=O)N[C@H](CC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C34H41N3O6/c1-23(38)35-29(21-31(40)43-22-25-15-9-6-10-16-25)33(42)36-28(19-24-13-7-5-8-14-24)30(39)20-26-17-11-12-18-27(26)32(41)37-34(2,3)4/h5-18,28-30,39H,19-22H2,1-4H3,(H,35,38)(H,36,42)(H,37,41)/t28-,29+,30+/m0/s1
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n/an/a 85n/an/an/an/a5.537



Lilly Research Laboratories



Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9629
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]car...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CSc1ccc(cc1)C(F)(F)F)NS(C)(=O)=O |r|
Show InChI InChI=1S/C32H38F3N3O5S2/c1-31(2,3)37-29(40)25-13-9-8-12-22(25)19-28(39)26(18-21-10-6-5-7-11-21)36-30(41)27(38-45(4,42)43)20-44-24-16-14-23(15-17-24)32(33,34)35/h5-17,26-28,38-39H,18-20H2,1-4H3,(H,36,41)(H,37,40)/t26-,27+,28+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9617
PNG
((S)-N-(1S,2R)-[3-[2-[[1,1-Dimethylethyl)amino]carb...)
Show SMILES CC(=O)N[C@H](CSc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C32H39N3O4S/c1-22(36)33-28(21-40-25-16-9-6-10-17-25)31(39)34-27(19-23-13-7-5-8-14-23)29(37)20-24-15-11-12-18-26(24)30(38)35-32(2,3)4/h5-18,27-29,37H,19-21H2,1-4H3,(H,33,36)(H,34,39)(H,35,38)/t27-,28+,29+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9611
PNG
((R)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)-amino]ca...)
Show SMILES CCCC(=O)N[C@H](CC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)Cc1ccccc1C(=O)NC(C)(C)C |r|
Show InChI InChI=1S/C36H45N3O6/c1-5-14-32(41)37-30(23-33(42)45-24-26-17-10-7-11-18-26)35(44)38-29(21-25-15-8-6-9-16-25)31(40)22-27-19-12-13-20-28(27)34(43)39-36(2,3)4/h6-13,15-20,29-31,40H,5,14,21-24H2,1-4H3,(H,37,41)(H,38,44)(H,39,43)/t29-,30+,31+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9627
PNG
((S)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)amino]]ca...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CSc1ccccn1)NS(C)(=O)=O |r|
Show InChI InChI=1S/C30H38N4O5S2/c1-30(2,3)33-28(36)23-15-9-8-14-22(23)19-26(35)24(18-21-12-6-5-7-13-21)32-29(37)25(34-41(4,38)39)20-40-27-16-10-11-17-31-27/h5-17,24-26,34-35H,18-20H2,1-4H3,(H,32,37)(H,33,36)/t24-,25+,26+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9607
PNG
(Carboxamide analog 2 | benzyl (3R)-3-{[(tert-butox...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(=O)OCc1ccccc1)NC(=O)OC(C)(C)C |r|
Show InChI InChI=1S/C37H47N3O7/c1-36(2,3)40-33(43)28-20-14-13-19-27(28)22-31(41)29(21-25-15-9-7-10-16-25)38-34(44)30(39-35(45)47-37(4,5)6)23-32(42)46-24-26-17-11-8-12-18-26/h7-20,29-31,41H,21-24H2,1-6H3,(H,38,44)(H,39,45)(H,40,43)/t29-,30+,31+/m0/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM9608
PNG
((R)-N-(1S,2R)-[3-[2-[[(1,1-Dimethylethyl)-amino]ca...)
Show SMILES CC(C)(C)NC(=O)c1ccccc1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](N)CC(=O)OCc1ccccc1 |r|
Show InChI InChI=1S/C32H39N3O5/c1-32(2,3)35-30(38)25-17-11-10-16-24(25)19-28(36)27(18-22-12-6-4-7-13-22)34-31(39)26(33)20-29(37)40-21-23-14-8-5-9-15-23/h4-17,26-28,36H,18-21,33H2,1-3H3,(H,34,39)(H,35,38)/t26-,27+,28-/m1/s1
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Assay Description
The assay involves the use of a HIV-1 protease peptide substrate which has been modified to contain a biotin moiety on one side and a fluorescent rep...

J Med Chem 39: 96-108 (1996)


Article DOI: 10.1021/jm950576c
BindingDB Entry DOI: 10.7270/Q23R0R3K
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%