Compile Data Set for Download or QSAR
Found 15 Enz. Inhib. hit(s) with all data for entry = 50006833
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503730(CHEMBL4443278)
Show SMILES N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CNCc3cccc(N)c3)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@H]1O
Show InChI InChI=1S/C19H33N5O6/c20-9-3-1-2-8(4-9)6-24-7-12-15(26)16(27)13(23)19(29-12)30-18-11(22)5-10(21)14(25)17(18)28/h1-4,10-19,24-28H,5-7,20-23H2/t10-,11+,12-,13-,14+,15-,16-,17-,18-,19-/m1/s1
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50248131(CHEMBL3754093)
Show SMILES NCC1OC(OC2C(CO)OC(OC3C(O)C(N)CC(N)C3OC3OC(CN)C(O)C(O)C3N)C2O)C(N)C(O)C1O
Show InChI InChI=1S/C23H46N6O13/c24-2-7-13(32)15(34)10(28)21(37-7)40-18-6(27)1-5(26)12(31)20(18)42-23-17(36)19(9(4-30)39-23)41-22-11(29)16(35)14(33)8(3-25)38-22/h5-23,30-36H,1-4,24-29H2/t5-,6+,7-,8?,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23+/m1/s1
Affinity DataIC50: 6.00E+3nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503727(CHEMBL4560686)
Show SMILES CC(C)(C)c1cc(CNC[C@H]2O[C@H](O[C@@H]3[C@@H](N)C[C@@H](N)[C@H](O)[C@H]3O)[C@H](N)[C@@H](O)[C@@H]2O)cc(c1O)C(C)(C)C
Show InChI InChI=1S/C27H48N4O7/c1-26(2,3)13-7-12(8-14(19(13)32)27(4,5)6)10-31-11-17-21(34)22(35)18(30)25(37-17)38-24-16(29)9-15(28)20(33)23(24)36/h7-8,15-18,20-25,31-36H,9-11,28-30H2,1-6H3/t15-,16+,17-,18-,20+,21-,22-,23-,24-,25-/m1/s1
Affinity DataIC50: 1.70E+4nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503720(CHEMBL4583631)
Show SMILES CCNC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C14H30N4O6/c1-2-18-4-7-10(20)11(21)8(17)14(23-7)24-13-6(16)3-5(15)9(19)12(13)22/h5-14,18-22H,2-4,15-17H2,1H3/t5-,6+,7-,8-,9+,10-,11-,12-,13-,14-/m1/s1
Affinity DataIC50: 1.90E+4nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503726(CHEMBL4483318)
Show SMILES COc1cc(CNC[C@H]2O[C@H](O[C@@H]3[C@@H](N)C[C@@H](N)[C@H](O)[C@H]3O)[C@H](N)[C@@H](O)[C@@H]2O)ccc1O
Show InChI InChI=1S/C20H34N4O8/c1-30-12-4-8(2-3-11(12)25)6-24-7-13-16(27)17(28)14(23)20(31-13)32-19-10(22)5-9(21)15(26)18(19)29/h2-4,9-10,13-20,24-29H,5-7,21-23H2,1H3/t9-,10+,13-,14-,15+,16-,17-,18-,19-,20-/m1/s1
Affinity DataIC50: 1.90E+4nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM8580((2R,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(1R,2...)
Show SMILES NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H26N4O6/c13-2-5-8(18)9(19)6(16)12(21-5)22-11-4(15)1-3(14)7(17)10(11)20/h3-12,17-20H,1-2,13-16H2/t3-,4+,5-,6-,7+,8-,9-,10-,11-,12-/m1/s1
Affinity DataIC50: 2.10E+4nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503725(CHEMBL4460970)
Show SMILES N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CNCc3ccc(cc3)[N+]([O-])=O)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@H]1O
Show InChI InChI=1S/C19H31N5O8/c20-10-5-11(21)18(17(28)14(10)25)32-19-13(22)16(27)15(26)12(31-19)7-23-6-8-1-3-9(4-2-8)24(29)30/h1-4,10-19,23,25-28H,5-7,20-22H2/t10-,11+,12-,13-,14+,15-,16-,17-,18-,19-/m1/s1
Affinity DataIC50: 2.50E+4nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503731(CHEMBL4466821)
Show SMILES N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CNCc3ccccc3O)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@H]1O
Show InChI InChI=1S/C19H32N4O7/c20-9-5-10(21)18(17(28)14(9)25)30-19-13(22)16(27)15(26)12(29-19)7-23-6-8-3-1-2-4-11(8)24/h1-4,9-10,12-19,23-28H,5-7,20-22H2/t9-,10+,12-,13-,14+,15-,16-,17-,18-,19-/m1/s1
Affinity DataIC50: 2.50E+4nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503719(CHEMBL4517375)
Show SMILES CCOc1cccc(CNC[C@H]2O[C@H](O[C@@H]3[C@@H](N)C[C@@H](N)[C@H](O)[C@H]3O)[C@H](N)[C@@H](O)[C@@H]2O)c1O
Show InChI InChI=1S/C21H36N4O8/c1-2-31-12-5-3-4-9(15(12)26)7-25-8-13-17(28)18(29)14(24)21(32-13)33-20-11(23)6-10(22)16(27)19(20)30/h3-5,10-11,13-14,16-21,25-30H,2,6-8,22-24H2,1H3/t10-,11+,13-,14-,16+,17-,18-,19-,20-,21-/m1/s1
Affinity DataIC50: 3.10E+4nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503729(CHEMBL4460433)
Show SMILES N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CNC\C=C\c3ccccc3)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@H]1O
Show InChI InChI=1S/C21H34N4O6/c22-12-9-13(23)20(19(29)16(12)26)31-21-15(24)18(28)17(27)14(30-21)10-25-8-4-7-11-5-2-1-3-6-11/h1-7,12-21,25-29H,8-10,22-24H2/b7-4+/t12-,13+,14-,15-,16+,17-,18-,19-,20-,21-/m1/s1
Affinity DataIC50: 3.20E+4nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503724(CHEMBL4539971)
Show SMILES N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CNCc3ccccc3)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@H]1O
Show InChI InChI=1S/C19H32N4O6/c20-10-6-11(21)18(17(27)14(10)24)29-19-13(22)16(26)15(25)12(28-19)8-23-7-9-4-2-1-3-5-9/h1-5,10-19,23-27H,6-8,20-22H2/t10-,11+,12-,13-,14+,15-,16-,17-,18-,19-/m1/s1
Affinity DataIC50: 6.30E+4nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503728(CHEMBL4531748)
Show SMILES N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CNCc3ccccc3Cl)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@H]1O
Show InChI InChI=1S/C19H31ClN4O6/c20-9-4-2-1-3-8(9)6-24-7-12-15(26)16(27)13(23)19(29-12)30-18-11(22)5-10(21)14(25)17(18)28/h1-4,10-19,24-28H,5-7,21-23H2/t10-,11+,12-,13-,14+,15-,16-,17-,18-,19-/m1/s1
Affinity DataIC50: 7.00E+4nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503723(CHEMBL4580827)
Show SMILES N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN(C\C=C\C=O)C\C=C\C=O)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@H]1O
Show InChI InChI=1S/C20H34N4O8/c21-11-9-12(22)19(18(30)15(11)27)32-20-14(23)17(29)16(28)13(31-20)10-24(5-1-3-7-25)6-2-4-8-26/h1-4,7-8,11-20,27-30H,5-6,9-10,21-23H2/b3-1+,4-2+/t11-,12+,13-,14-,15+,16-,17-,18-,19-,20-/m1/s1
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503722(CHEMBL4585318)
Show SMILES C\C=C(/C)CNC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C17H34N4O6/c1-3-7(2)5-21-6-10-13(23)14(24)11(20)17(26-10)27-16-9(19)4-8(18)12(22)15(16)25/h3,8-17,21-25H,4-6,18-20H2,1-2H3/b7-3+/t8-,9+,10-,11-,12+,13-,14-,15-,16-,17-/m1/s1
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetProtein Rev(Human immunodeficiency virus 1)
The University of Manchester

Curated by ChEMBL
LigandPNGBDBM50503721(CHEMBL4435966)
Show SMILES N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CNCC3CCCCC3)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@H]1O
Show InChI InChI=1S/C19H38N4O6/c20-10-6-11(21)18(17(27)14(10)24)29-19-13(22)16(26)15(25)12(28-19)8-23-7-9-4-2-1-3-5-9/h9-19,23-27H,1-8,20-22H2/t10-,11+,12-,13-,14+,15-,16-,17-,18-,19-/m1/s1
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid