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Compile Data Set for Download or QSAR

Found 4099 hits Enz. Inhib. hit(s) with Target = 'Reverse transcriptase'   
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
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22615
PNG
(2-[(2S,4R)-1,4-dimethylpyrrolidin-2-yl]-N-[(4-fluo...)
Show SMILES C[C@@H]1C[C@H](N(C)C1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C19H23FN4O3/c1-11-8-14(23(2)10-11)17-22-15(16(25)19(27)24(17)3)18(26)21-9-12-4-6-13(20)7-5-12/h4-7,11,14,25H,8-10H2,1-3H3,(H,21,26)/t11-,14+/m1/s1
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n/an/a 190n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22616
PNG
(2-(1,5-dimethylpyrrolidin-2-yl)-N-[(4-fluorophenyl...)
Show SMILES CC1CCC(N1C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C19H23FN4O3/c1-11-4-9-14(23(11)2)17-22-15(16(25)19(27)24(17)3)18(26)21-10-12-5-7-13(20)8-6-12/h5-8,11,14,25H,4,9-10H2,1-3H3,(H,21,26)
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n/an/a 690n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22617
PNG
(N-Me-pyrimidone deriv., 16 | N-[(4-fluorophenyl)me...)
Show SMILES CN1C[C@H](O)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C18H21FN4O4/c1-22-9-12(24)7-13(22)16-21-14(15(25)18(27)23(16)2)17(26)20-8-10-3-5-11(19)6-4-10/h3-6,12-13,24-25H,7-9H2,1-2H3,(H,20,26)/t12-,13+/m1/s1
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n/an/a 100n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22618
PNG
(N-Me-pyrimidone deriv., 17 | N-[(4-fluorophenyl)me...)
Show SMILES CO[C@@H]1C[C@H](N(C)C1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C19H23FN4O4/c1-23-10-13(28-3)8-14(23)17-22-15(16(25)19(27)24(17)2)18(26)21-9-11-4-6-12(20)7-5-11/h4-7,13-14,25H,8-10H2,1-3H3,(H,21,26)/t13-,14+/m1/s1
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n/an/a 180n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22619
PNG
(2-[(2S,4R)-4-ethoxy-1-methylpyrrolidin-2-yl]-N-[(4...)
Show SMILES CCO[C@@H]1C[C@H](N(C)C1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C20H25FN4O4/c1-4-29-14-9-15(24(2)11-14)18-23-16(17(26)20(28)25(18)3)19(27)22-10-12-5-7-13(21)8-6-12/h5-8,14-15,26H,4,9-11H2,1-3H3,(H,22,27)/t14-,15+/m1/s1
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n/an/a 200n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22620
PNG
(2-[(2S,4R)-4-(benzyloxy)-1-methylpyrrolidin-2-yl]-...)
Show SMILES CN1C[C@@H](C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C)OCc1ccccc1
Show InChI InChI=1S/C25H27FN4O4/c1-29-14-19(34-15-17-6-4-3-5-7-17)12-20(29)23-28-21(22(31)25(33)30(23)2)24(32)27-13-16-8-10-18(26)11-9-16/h3-11,19-20,31H,12-15H2,1-2H3,(H,27,32)/t19-,20+/m1/s1
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n/an/a 130n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22621
PNG
(N-Me-pyrimidone deriv., 20 | N-[(4-fluorophenyl)me...)
Show SMILES CN1C[C@H](C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C)NS(C)(=O)=O
Show InChI InChI=1S/C19H24FN5O5S/c1-24-10-13(23-31(3,29)30)8-14(24)17-22-15(16(26)19(28)25(17)2)18(27)21-9-11-4-6-12(20)7-5-11/h4-7,13-14,23,26H,8-10H2,1-3H3,(H,21,27)/t13-,14-/m0/s1
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n/an/a 30n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22622
PNG
(2-[(2S,4S)-4-acetamido-1-methylpyrrolidin-2-yl]-N-...)
Show SMILES CN1C[C@H](C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C)NC(C)=O
Show InChI InChI=1S/C20H24FN5O4/c1-11(27)23-14-8-15(25(2)10-14)18-24-16(17(28)20(30)26(18)3)19(29)22-9-12-4-6-13(21)7-5-12/h4-7,14-15,28H,8-10H2,1-3H3,(H,22,29)(H,23,27)/t14-,15-/m0/s1
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n/an/a 61n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22623
PNG
(2-[(2S,4S)-4-fluoro-1-methylpyrrolidin-2-yl]-N-[(4...)
Show SMILES CN1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C18H20F2N4O3/c1-23-9-12(20)7-13(23)16-22-14(15(25)18(27)24(16)2)17(26)21-8-10-3-5-11(19)6-4-10/h3-6,12-13,25H,7-9H2,1-2H3,(H,21,26)/t12-,13-/m0/s1
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n/an/a 20n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22624
PNG
(2-[(2S,4R)-4-fluoro-1-methylpyrrolidin-2-yl]-N-[(4...)
Show SMILES CN1C[C@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C18H20F2N4O3/c1-23-9-12(20)7-13(23)16-22-14(15(25)18(27)24(16)2)17(26)21-8-10-3-5-11(19)6-4-10/h3-6,12-13,25H,7-9H2,1-2H3,(H,21,26)/t12-,13+/m1/s1
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n/an/a 20n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22625
PNG
(2-[(2S)-4,4-difluoro-1-methylpyrrolidin-2-yl]-N-[(...)
Show SMILES CN1CC(F)(F)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C18H19F3N4O3/c1-24-9-18(20,21)7-12(24)15-23-13(14(26)17(28)25(15)2)16(27)22-8-10-3-5-11(19)6-4-10/h3-6,12,26H,7-9H2,1-2H3,(H,22,27)/t12-/m0/s1
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n/an/a 30n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22626
PNG
(N-Me-pyrimidone deriv., 25 | N-[(4-fluorophenyl)me...)
Show SMILES CN1CC[C@@H](O)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C19H23FN4O4/c1-23-8-7-13(25)9-14(23)17-22-15(16(26)19(28)24(17)2)18(27)21-10-11-3-5-12(20)6-4-11/h3-6,13-14,25-26H,7-10H2,1-2H3,(H,21,27)/t13-,14+/m1/s1
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n/an/a 21n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22627
PNG
(2-[(2S,4R)-4-(benzyloxy)-1-methylpiperidin-2-yl]-N...)
Show SMILES CN1CC[C@H](C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C)OCc1ccccc1
Show InChI InChI=1S/C26H29FN4O4/c1-30-13-12-20(35-16-18-6-4-3-5-7-18)14-21(30)24-29-22(23(32)26(34)31(24)2)25(33)28-15-17-8-10-19(27)11-9-17/h3-11,20-21,32H,12-16H2,1-2H3,(H,28,33)/t20-,21+/m1/s1
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n/an/a 62n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22628
PNG
(JMC51861 Compound 4 | N-Me-pyrimidone deriv., 27 |...)
Show SMILES CN1CCOCC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C18H21FN4O4/c1-22-7-8-27-10-13(22)16-21-14(15(24)18(26)23(16)2)17(25)20-9-11-3-5-12(19)6-4-11/h3-6,13,24H,7-10H2,1-2H3,(H,20,25)
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n/an/a 60n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22629
PNG
(N-Me-pyrimidone deriv., 28 | N-[(4-fluorophenyl)me...)
Show SMILES CN1CCSCC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C18H21FN4O3S/c1-22-7-8-27-10-13(22)16-21-14(15(24)18(26)23(16)2)17(25)20-9-11-3-5-12(19)6-4-11/h3-6,13,24H,7-10H2,1-2H3,(H,20,25)
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n/an/a 70n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22630
PNG
(A 9:1 mixture, undetermined stereochemistry. | N-M...)
Show SMILES CN1CCS(=O)CC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C18H21FN4O4S/c1-22-7-8-28(27)10-13(22)16-21-14(15(24)18(26)23(16)2)17(25)20-9-11-3-5-12(19)6-4-11/h3-6,13,24H,7-10H2,1-2H3,(H,20,25)
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n/an/a 37n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22631
PNG
(N-Me-pyrimidone deriv., 30 | N-[(4-fluorophenyl)me...)
Show SMILES CN1CCS(=O)(=O)CC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C18H21FN4O5S/c1-22-7-8-29(27,28)10-13(22)16-21-14(15(24)18(26)23(16)2)17(25)20-9-11-3-5-12(19)6-4-11/h3-6,13,24H,7-10H2,1-2H3,(H,20,25)
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n/an/a 140n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22632
PNG
(2-(1,4-dimethylpiperazin-2-yl)-N-[(4-fluorophenyl)...)
Show SMILES CN1CCN(C)C(C1)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C19H24FN5O3/c1-23-8-9-24(2)14(11-23)17-22-15(16(26)19(28)25(17)3)18(27)21-10-12-4-6-13(20)7-5-12/h4-7,14,26H,8-11H2,1-3H3,(H,21,27)
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n/an/a 100n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22633
PNG
(2-(1,4-dimethyl-5-oxopiperazin-2-yl)-N-[(4-fluorop...)
Show SMILES CN1CC(=O)N(C)CC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C19H22FN5O4/c1-23-10-14(26)24(2)9-13(23)17-22-15(16(27)19(29)25(17)3)18(28)21-8-11-4-6-12(20)7-5-11/h4-7,13,27H,8-10H2,1-3H3,(H,21,28)
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n/an/a 50n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22634
PNG
(N-Me-pyrimidone deriv., 33 | N-[(4-fluorophenyl)me...)
Show SMILES CN1CCNCC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C18H22FN5O3/c1-23-8-7-20-10-13(23)16-22-14(15(25)18(27)24(16)2)17(26)21-9-11-3-5-12(19)6-4-11/h3-6,13,20,25H,7-10H2,1-2H3,(H,21,26)
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n/an/a 200n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 50: 4953-75 (2007)


Article DOI: 10.1021/jm0704705
BindingDB Entry DOI: 10.7270/Q2BZ64BS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22663
PNG
(JMC496646 Compound 6 | N-[(4-fluorophenyl)methyl]-...)
Show SMILES Oc1c(nc[nH]c1=O)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C12H10FN3O3/c13-8-3-1-7(2-4-8)5-14-11(18)9-10(17)12(19)16-6-15-9/h1-4,6,17H,5H2,(H,14,18)(H,15,16,19)
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n/an/a 60n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22664
PNG
(2-[1-(dimethylamino)ethyl]-N-[(4-fluorophenyl)meth...)
Show SMILES CC(N(C)C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1
Show InChI InChI=1S/C16H19FN4O3/c1-9(21(2)3)14-19-12(13(22)16(24)20-14)15(23)18-8-10-4-6-11(17)7-5-10/h4-7,9,22H,8H2,1-3H3,(H,18,23)(H,19,20,24)
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n/an/a 100n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22646
PNG
(N-[(4-fluorophenyl)methyl]-5-hydroxy-2-(4-methylmo...)
Show SMILES CN1CCOCC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1
Show InChI InChI=1S/C17H19FN4O4/c1-22-6-7-26-9-12(22)15-20-13(14(23)17(25)21-15)16(24)19-8-10-2-4-11(18)5-3-10/h2-5,12,23H,6-9H2,1H3,(H,19,24)(H,20,21,25)
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n/an/a 10n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22628
PNG
(JMC51861 Compound 4 | N-Me-pyrimidone deriv., 27 |...)
Show SMILES CN1CCOCC1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C
Show InChI InChI=1S/C18H21FN4O4/c1-22-7-8-27-10-13(22)16-21-14(15(24)18(26)23(16)2)17(25)20-9-11-3-5-12(19)6-4-11/h3-6,13,24H,7-10H2,1-2H3,(H,20,25)
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n/an/a 60n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22666
PNG
(8-(dimethylamino)-N-[(4-fluorophenyl)methyl]-3-hyd...)
Show SMILES CN(C)C1CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Show InChI InChI=1S/C17H19FN4O3/c1-21(2)12-7-8-22-15(12)20-13(14(23)17(22)25)16(24)19-9-10-3-5-11(18)6-4-10/h3-6,12,23H,7-9H2,1-2H3,(H,19,24)
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n/an/a 7n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22667
PNG
(9-(dimethylamino)-N-[(4-fluorophenyl)methyl]-3-hyd...)
Show SMILES CN(C)C1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Show InChI InChI=1S/C18H21FN4O3/c1-22(2)13-4-3-9-23-16(13)21-14(15(24)18(23)26)17(25)20-10-11-5-7-12(19)8-6-11/h5-8,13,24H,3-4,9-10H2,1-2H3,(H,20,25)
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n/an/a 69n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22668
PNG
(10-(dimethylamino)-N-[(4-fluorophenyl)methyl]-3-hy...)
Show SMILES CN(C)C1CCCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Show InChI InChI=1S/C19H23FN4O3/c1-23(2)14-5-3-4-10-24-17(14)22-15(16(25)19(24)27)18(26)21-11-12-6-8-13(20)9-7-12/h6-9,14,25H,3-5,10-11H2,1-2H3,(H,21,26)
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n/an/a 550n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22669
PNG
(Bicyclic pyrimidinone, 8b | N-[(4-fluorophenyl)met...)
Show SMILES Oc1c(nc2C(CCCn2c1=O)N1CCCC1)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C20H23FN4O3/c21-14-7-5-13(6-8-14)12-22-19(27)16-17(26)20(28)25-11-3-4-15(18(25)23-16)24-9-1-2-10-24/h5-8,15,26H,1-4,9-12H2,(H,22,27)
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n/an/a 63n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22670
PNG
(Bicyclic pyrimidinone, 9b | N-[(4-fluorophenyl)met...)
Show SMILES Oc1c(nc2C(CCCn2c1=O)N1CCCCC1)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C21H25FN4O3/c22-15-8-6-14(7-9-15)13-23-20(28)17-18(27)21(29)26-12-4-5-16(19(26)24-17)25-10-2-1-3-11-25/h6-9,16,27H,1-5,10-13H2,(H,23,28)
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n/an/a 4n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22671
PNG
(Bicyclic pyrimidinone, 10b | N-[(4-fluorophenyl)me...)
Show SMILES Oc1c(nc2C(CCCn2c1=O)N1CCOCC1)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C20H23FN4O4/c21-14-5-3-13(4-6-14)12-22-19(27)16-17(26)20(28)25-7-1-2-15(18(25)23-16)24-8-10-29-11-9-24/h3-6,15,26H,1-2,7-12H2,(H,22,27)
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n/an/a 5n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22672
PNG
(Bicyclic pyrimidinone, 10c | N-[(4-fluorophenyl)me...)
Show SMILES Oc1c(nc2C(CCCCn2c1=O)N1CCOCC1)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C21H25FN4O4/c22-15-6-4-14(5-7-15)13-23-20(28)17-18(27)21(29)26-8-2-1-3-16(19(26)24-17)25-9-11-30-12-10-25/h4-7,16,27H,1-3,8-13H2,(H,23,28)
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n/an/a 62n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22673
PNG
(9-[benzyl(methyl)amino]-N-[(4-fluorophenyl)methyl]...)
Show SMILES CN(Cc1ccccc1)C1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Show InChI InChI=1S/C24H25FN4O3/c1-28(15-17-6-3-2-4-7-17)19-8-5-13-29-22(19)27-20(21(30)24(29)32)23(31)26-14-16-9-11-18(25)12-10-16/h2-4,6-7,9-12,19,30H,5,8,13-15H2,1H3,(H,26,31)
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n/an/a 4n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22674
PNG
(10-[benzyl(methyl)amino]-N-[(4-fluorophenyl)methyl...)
Show SMILES CN(Cc1ccccc1)C1CCCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Show InChI InChI=1S/C25H27FN4O3/c1-29(16-18-7-3-2-4-8-18)20-9-5-6-14-30-23(20)28-21(22(31)25(30)33)24(32)27-15-17-10-12-19(26)13-11-17/h2-4,7-8,10-13,20,31H,5-6,9,14-16H2,1H3,(H,27,32)
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n/an/a 62n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22675
PNG
(Bicyclic pyrimidinone, 12a | N-[(4-fluorophenyl)me...)
Show SMILES Oc1c(nc2CCCn2c1=O)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C15H14FN3O3/c16-10-5-3-9(4-6-10)8-17-14(21)12-13(20)15(22)19-7-1-2-11(19)18-12/h3-6,20H,1-2,7-8H2,(H,17,21)
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n/an/a 8n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22676
PNG
(Bicyclic pyrimidinone, 12b | N-[(4-fluorophenyl)me...)
Show SMILES Oc1c(nc2CCCCn2c1=O)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C16H16FN3O3/c17-11-6-4-10(5-7-11)9-18-15(22)13-14(21)16(23)20-8-2-1-3-12(20)19-13/h4-7,21H,1-3,8-9H2,(H,18,22)
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n/an/a 5n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22677
PNG
(Bicyclic pyrimidinone, 12c | N-[(4-fluorophenyl)me...)
Show SMILES Oc1c(nc2CCCCCn2c1=O)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C17H18FN3O3/c18-12-7-5-11(6-8-12)10-19-16(23)14-15(22)17(24)21-9-3-1-2-4-13(21)20-14/h5-8,22H,1-4,9-10H2,(H,19,23)
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n/an/a 19n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22678
PNG
(Bicyclic pyrimidinone, 13a | N-[(4-fluorophenyl)me...)
Show SMILES CN(C1CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)C(C)=O
Show InChI InChI=1S/C18H19FN4O4/c1-10(24)22(2)13-7-8-23-16(13)21-14(15(25)18(23)27)17(26)20-9-11-3-5-12(19)6-4-11/h3-6,13,25H,7-9H2,1-2H3,(H,20,26)
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n/an/a 9n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22679
PNG
(Bicyclic pyrimidinone, 13b | N-[(4-fluorophenyl)me...)
Show SMILES CN(C1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)C(C)=O
Show InChI InChI=1S/C19H21FN4O4/c1-11(25)23(2)14-4-3-9-24-17(14)22-15(16(26)19(24)28)18(27)21-10-12-5-7-13(20)8-6-12/h5-8,14,26H,3-4,9-10H2,1-2H3,(H,21,27)
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n/an/a 6n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22680
PNG
(Bicyclic pyrimidinone, 13c | N-[(4-fluorophenyl)me...)
Show SMILES CN(C1CCCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)C(C)=O
Show InChI InChI=1S/C20H23FN4O4/c1-12(26)24(2)15-5-3-4-10-25-18(15)23-16(17(27)20(25)29)19(28)22-11-13-6-8-14(21)9-7-13/h6-9,15,27H,3-5,10-11H2,1-2H3,(H,22,28)
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n/an/a 8n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22681
PNG
(9-(2,2-difluoro-N-methylacetamido)-N-[(4-fluorophe...)
Show SMILES CN(C1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)C(=O)C(F)F
Show InChI InChI=1S/C19H19F3N4O4/c1-25(19(30)15(21)22)12-3-2-8-26-16(12)24-13(14(27)18(26)29)17(28)23-9-10-4-6-11(20)7-5-10/h4-7,12,15,27H,2-3,8-9H2,1H3,(H,23,28)
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n/an/a 18n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22682
PNG
(Bicyclic pyrimidinone, 15b | N-[(4-fluorophenyl)me...)
Show SMILES CN(C1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)C(=O)Cn1cccn1
Show InChI InChI=1S/C22H23FN6O4/c1-27(17(30)13-28-10-3-9-25-28)16-4-2-11-29-20(16)26-18(19(31)22(29)33)21(32)24-12-14-5-7-15(23)8-6-14/h3,5-10,16,31H,2,4,11-13H2,1H3,(H,24,32)
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n/an/a 3n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22683
PNG
(2-N-[(4-fluorophenyl)methyl]-3-hydroxy-9-N-methyl-...)
Show SMILES CN(C1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)C(=O)c1nc2ncccn2n1
Show InChI InChI=1S/C23H21FN8O4/c1-30(22(36)18-28-23-25-9-3-11-32(23)29-18)15-4-2-10-31-19(15)27-16(17(33)21(31)35)20(34)26-12-13-5-7-14(24)8-6-13/h3,5-9,11,15,33H,2,4,10,12H2,1H3,(H,26,34)
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n/an/a 10n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22684
PNG
(9-[2-(dimethylsulfamoyl)-N-methylacetamido]-N-[(4-...)
Show SMILES CN(C)S(=O)(=O)CC(=O)N(C)C1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Show InChI InChI=1S/C21H26FN5O6S/c1-25(2)34(32,33)12-16(28)26(3)15-5-4-10-27-19(15)24-17(18(29)21(27)31)20(30)23-11-13-6-8-14(22)9-7-13/h6-9,15,29H,4-5,10-12H2,1-3H3,(H,23,30)
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n/an/a 9n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22685
PNG
((9R)-9-[2-(dimethylsulfamoyl)-N-methylacetamido]-N...)
Show SMILES CN(C)S(=O)(=O)CC(=O)N(C)[C@@H]1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Show InChI InChI=1S/C21H26FN5O6S/c1-25(2)34(32,33)12-16(28)26(3)15-5-4-10-27-19(15)24-17(18(29)21(27)31)20(30)23-11-13-6-8-14(22)9-7-13/h6-9,15,29H,4-5,10-12H2,1-3H3,(H,23,30)/t15-/m1/s1
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n/an/a 7n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22686
PNG
((9S)-9-[2-(dimethylsulfamoyl)-N-methylacetamido]-N...)
Show SMILES CN(C)S(=O)(=O)CC(=O)N(C)[C@H]1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Show InChI InChI=1S/C21H26FN5O6S/c1-25(2)34(32,33)12-16(28)26(3)15-5-4-10-27-19(15)24-17(18(29)21(27)31)20(30)23-11-13-6-8-14(22)9-7-13/h6-9,15,29H,4-5,10-12H2,1-3H3,(H,23,30)/t15-/m0/s1
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n/an/a 7n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22687
PNG
(Bicyclic pyrimidinone, 18b | N-[(4-fluorophenyl)me...)
Show SMILES CN(C1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)C(=O)CS(C)(=O)=O
Show InChI InChI=1S/C20H23FN4O6S/c1-24(15(26)11-32(2,30)31)14-4-3-9-25-18(14)23-16(17(27)20(25)29)19(28)22-10-12-5-7-13(21)8-6-12/h5-8,14,27H,3-4,9-11H2,1-2H3,(H,22,28)
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n/an/a 6n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22688
PNG
(Bicyclic pyrimidinone, 18c | N-[(4-fluorophenyl)me...)
Show SMILES CN(C1CCCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)C(=O)CS(C)(=O)=O
Show InChI InChI=1S/C21H25FN4O6S/c1-25(16(27)12-33(2,31)32)15-5-3-4-10-26-19(15)24-17(18(28)21(26)30)20(29)23-11-13-6-8-14(22)9-7-13/h6-9,15,28H,3-5,10-12H2,1-2H3,(H,23,29)
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n/an/a 17n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22689
PNG
(Bicyclic pyrimidinone, 19b | N-[(4-fluorophenyl)me...)
Show SMILES CS(=O)(=O)CC(=O)NC1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Show InChI InChI=1S/C19H21FN4O6S/c1-31(29,30)10-14(25)22-13-3-2-8-24-17(13)23-15(16(26)19(24)28)18(27)21-9-11-4-6-12(20)7-5-11/h4-7,13,26H,2-3,8-10H2,1H3,(H,21,27)(H,22,25)
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n/an/a 7n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22690
PNG
(Bicyclic pyrimidinone, 20b | N-[(4-fluorophenyl)me...)
Show SMILES CN(C1CCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)S(C)(=O)=O
Show InChI InChI=1S/C18H21FN4O5S/c1-22(29(2,27)28)13-4-3-9-23-16(13)21-14(15(24)18(23)26)17(25)20-10-11-5-7-12(19)8-6-11/h5-8,13,24H,3-4,9-10H2,1-2H3,(H,20,25)
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n/an/a 12n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22691
PNG
(Bicyclic pyrimidinone, 20c | N-[(4-fluorophenyl)me...)
Show SMILES CN(C1CCCCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O)S(C)(=O)=O
Show InChI InChI=1S/C19H23FN4O5S/c1-23(30(2,28)29)14-5-3-4-10-24-17(14)22-15(16(25)19(24)27)18(26)21-11-12-6-8-13(20)9-7-12/h6-9,14,25H,3-5,10-11H2,1-2H3,(H,21,26)
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n/an/a 16n/an/an/an/a7.837



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair
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