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Compile Data Set for Download or QSAR

Found 96 hits of ic50 for UniProtKB: P04618   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protein Rev


(Human immunodeficiency virus 1)
BDBM50097337
PNG
(CHEMBL349996 | Neamine derivative)
Show SMILES NC1CC(N)C(OC2OC(CNC(=O)C(CCCNC(N)=N)NC(=O)c3ccc4ccc5cccc6ccc3c4c56)C(O)C(O)C2N)C(O)C1O
Show InChI InChI=1S/C35H46N8O8/c36-20-13-21(37)31(30(47)27(20)44)51-34-26(38)29(46)28(45)23(50-34)14-42-33(49)22(5-2-12-41-35(39)40)43-32(48)19-11-9-17-7-6-15-3-1-4-16-8-10-18(19)25(17)24(15)16/h1,3-4,6-11,20-23,26-31,34,44-47H,2,5,12-14,36-38H2,(H,42,49)(H,43,48)(H4,39,40,41)
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n/an/a 350n/an/an/an/an/an/a



Graduate School of Bioscience and Biotechnology

Curated by ChEMBL


Assay Description
Compound was evaluated for its inhibitory activity against Klenow enzyme


Bioorg Med Chem Lett 11: 591-4 (2001)


BindingDB Entry DOI: 10.7270/Q2G44QT9
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM50097335
PNG
(2-Amino-5-guanidino-pentanoic acid [(4R,5S,6S)-5-a...)
Show SMILES NC(CCCNC(N)=N)C(=O)NCC1OC(OC2C(N)CC(N)C(O)C2O)C(N)C(O)C1O
Show InChI InChI=1S/C18H38N8O7/c19-6(2-1-3-25-18(23)24)16(31)26-5-9-12(28)13(29)10(22)17(32-9)33-15-8(21)4-7(20)11(27)14(15)30/h6-15,17,27-30H,1-5,19-22H2,(H,26,31)(H4,23,24,25)
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n/an/a 460n/an/an/an/an/an/a



Graduate School of Bioscience and Biotechnology

Curated by ChEMBL


Assay Description
Inhibitory activity against peptide binding to the RRE RNA was determined


Bioorg Med Chem Lett 11: 591-4 (2001)


BindingDB Entry DOI: 10.7270/Q2G44QT9
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM51208
PNG
((4-nitrobenzofurazan-5-yl)amine | 4-nitro-2,1,3-be...)
Show SMILES Nc1ccc2nonc2c1[N+]([O-])=O
Show InChI InChI=1S/C6H4N4O3/c7-3-1-2-4-5(9-13-8-4)6(3)10(11)12/h1-2H,7H2
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n/an/a 690n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM50503730
PNG
(CHEMBL4443278)
Show SMILES [H][C@]1(O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O)O[C@H](CNCc2cccc(N)c2)[C@@H](O)[C@H](O)[C@H]1N |r|
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
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n/an/a 1.00E+3n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...


Bioorg Med Chem Lett 29: 339-341 (2019)


Article DOI: 10.1016/j.bmcl.2018.11.004
BindingDB Entry DOI: 10.7270/Q2Z60S9X
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM50181
PNG
(1-{[4-(dimethylamino)phenyl]amino}-3-methyl-3H-nap...)
Show SMILES CN(C)c1ccc(Nc2c3-c4ccccc4C(=O)c4cccc(n(C)c2=O)c34)cc1
Show InChI InChI=1S/C25H21N3O2/c1-27(2)16-13-11-15(12-14-16)26-23-22-17-7-4-5-8-18(17)24(29)19-9-6-10-20(21(19)22)28(3)25(23)30/h4-14,26H,1-3H3
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n/an/a 1.05E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM64781
PNG
(4-[[2-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)hydrazi...)
Show SMILES Oc1ccc(CN=Nc2cc(nc(n2)N2CCCC2)N2CCCC2)cc1 |w:7.7|
Show InChI InChI=1S/C19H24N6O/c26-16-7-5-15(6-8-16)14-20-23-17-13-18(24-9-1-2-10-24)22-19(21-17)25-11-3-4-12-25/h5-8,13,26H,1-4,9-12,14H2
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n/an/a 1.36E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM52393
PNG
((2Z)-2-(nitromethylene)-3-phenyl-thiazolidin-4-one...)
Show SMILES [O-][N+](=O)\C=C1/SCC(=O)N1c1ccccc1
Show InChI InChI=1S/C10H8N2O3S/c13-9-7-16-10(6-11(14)15)12(9)8-4-2-1-3-5-8/h1-6H,7H2/b10-6-
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n/an/a 3.04E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM51118
PNG
(2-[3-(2-amino-5-bromo-phenyl)-2-keto-quinoxalin-1-...)
Show SMILES CCOC(=O)Cn1c2ccccc2nc(-c2cc(Br)ccc2N)c1=O
Show InChI InChI=1S/C18H16BrN3O3/c1-2-25-16(23)10-22-15-6-4-3-5-14(15)21-17(18(22)24)12-9-11(19)7-8-13(12)20/h3-9H,2,10,20H2,1H3
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n/an/a 4.53E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM51067
PNG
(3-aminobenzoic acid [2-[(9,10-diketo-1-anthryl)ami...)
Show SMILES Nc1cccc(c1)C(=O)OCC(=O)Nc1cccc2C(=O)c3ccccc3C(=O)c12
Show InChI InChI=1S/C23H16N2O5/c24-14-6-3-5-13(11-14)23(29)30-12-19(26)25-18-10-4-9-17-20(18)22(28)16-8-2-1-7-15(16)21(17)27/h1-11H,12,24H2,(H,25,26)
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n/an/a 5.22E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM50248131
PNG
(CHEMBL3754093)
Show SMILES [H]C1(OC2C(O)C(N)CC(N)C2OC2([H])OC(CN)C(O)C(O)C2N)OC(CO)C(OC2([H])OC(CN)C(O)C(O)C2N)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
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n/an/a 6.00E+3n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...


Bioorg Med Chem Lett 29: 339-341 (2019)


Article DOI: 10.1016/j.bmcl.2018.11.004
BindingDB Entry DOI: 10.7270/Q2Z60S9X
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM51301
PNG
(5-chloranyl-N-(6-methoxypyridin-3-yl)thiophene-2-s...)
Show SMILES COc1ccc(NS(=O)(=O)c2ccc(Cl)s2)cn1
Show InChI InChI=1S/C10H9ClN2O3S2/c1-16-9-4-2-7(6-12-9)13-18(14,15)10-5-3-8(11)17-10/h2-6,13H,1H3
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n/an/a 6.30E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM51288
PNG
(MLS000768263 | N-(3-Butyl-2,4-dioxo-1,2,3,4-tetrah...)
Show SMILES CCCCn1c(=O)[nH]c2nc3cc(NC(C)=O)ccc3nc2c1=O
Show InChI InChI=1S/C16H17N5O3/c1-3-4-7-21-15(23)13-14(20-16(21)24)19-12-8-10(17-9(2)22)5-6-11(12)18-13/h5-6,8H,3-4,7H2,1-2H3,(H,17,22)(H,19,20,24)
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n/an/a 6.50E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM53371
PNG
(MLS001097825 | N-(6-amino-1-isobutyl-2,4-diketo-py...)
Show SMILES CCCCN(C(=O)c1ccc(o1)[N+]([O-])=O)c1c(N)n(CC(C)C)c(=O)[nH]c1=O
Show InChI InChI=1S/C17H23N5O6/c1-4-5-8-20(16(24)11-6-7-12(28-11)22(26)27)13-14(18)21(9-10(2)3)17(25)19-15(13)23/h6-7,10H,4-5,8-9,18H2,1-3H3,(H,19,23,25)
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n/an/a 7.26E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM31709
PNG
(4-amino-2-phenyl-isoindoline-1,3-quinone | 4-amino...)
Show SMILES Nc1cccc2C(=O)N(C(=O)c12)c1ccccc1
Show InChI InChI=1S/C14H10N2O2/c15-11-8-4-7-10-12(11)14(18)16(13(10)17)9-5-2-1-3-6-9/h1-8H,15H2
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n/an/a 7.86E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM81982
PNG
(CAS_97-39-2 | DITOLYLGUANIDINE | DTG | Di-o-tolylg...)
Show SMILES Cc1ccccc1NC(N)=Nc1ccccc1C |w:10.11|
Show InChI InChI=1S/C15H17N3/c1-11-7-3-5-9-13(11)17-15(16)18-14-10-6-4-8-12(14)2/h3-10H,1-2H3,(H3,16,17,18)
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n/an/a 8.31E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67453
PNG
(MLS002276353 | SMR001317988 | cid_44202984)
Show SMILES Nc1ncc[nH]1.[H][C@@]12CC[C@@H](C(C)CCC(C)C(C)(C)C)[C@@]1(C)CC[C@@]1([H])C2C[C@H](OS(O)(=S)=S)[C@@]2([H])C[C@H](OS(O)(=S)=S)[C@H](C[C@]12C)OS(O)(=S)=S
Show InChI InChI=1S/C29H52O6S9.C3H5N3/c1-17(8-9-18(2)27(3,4)5)20-10-11-21-19-14-24(33-42(30,36)37)23-15-25(34-43(31,38)39)26(35-44(32,40)41)16-29(23,7)22(19)12-13-28(20,21)6;4-3-5-1-2-6-3/h17-26H,8-16H2,1-7H3,(H,30,36,37)(H,31,38,39)(H,32,40,41);1-2H,(H3,4,5,6)/t17?,18?,19?,20-,21-,22-,23+,24-,25-,26-,28+,29+;/m0./s1
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n/an/a 8.34E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67448
PNG
(MLS001142046 | N-(6-amino-1-benzyl-2,4-diketo-pyri...)
Show SMILES CC(C)CCN(C(=O)CCCSc1nc2ccccc2[nH]1)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O
Show InChI InChI=1S/C27H32N6O3S/c1-18(2)14-15-32(22(34)13-8-16-37-26-29-20-11-6-7-12-21(20)30-26)23-24(28)33(27(36)31-25(23)35)17-19-9-4-3-5-10-19/h3-7,9-12,18H,8,13-17,28H2,1-2H3,(H,29,30)(H,31,35,36)
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n/an/a>8.38E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67451
PNG
(2-(4-amino-1,3-diketo-isoindolin-2-yl)-N-cyclohexy...)
Show SMILES CN(C1CCCCC1)C(=O)CN1C(=O)c2cccc(N)c2C1=O
Show InChI InChI=1S/C17H21N3O3/c1-19(11-6-3-2-4-7-11)14(21)10-20-16(22)12-8-5-9-13(18)15(12)17(20)23/h5,8-9,11H,2-4,6-7,10,18H2,1H3
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n/an/a>8.39E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67424
PNG
((6E)-2-allyl-6-[[(3,5-dimethyl-1,2,4-triazol-4-yl)...)
Show SMILES Cc1nnc(C)n1N=Cc1cccc(CC=C)c1O |w:7.7|
Show InChI InChI=1S/C14H16N4O/c1-4-6-12-7-5-8-13(14(12)19)9-15-18-10(2)16-17-11(18)3/h4-5,7-9,19H,1,6H2,2-3H3
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The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM53055
PNG
(1-[Bis-(2-hydroxy-ethyl)-amino]-anthraquinone | 1-...)
Show SMILES OCCN(CCO)c1cccc2C(=O)c3ccccc3C(=O)c12
Show InChI InChI=1S/C18H17NO4/c20-10-8-19(9-11-21)15-7-3-6-14-16(15)18(23)13-5-2-1-4-12(13)17(14)22/h1-7,20-21H,8-11H2
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n/an/a 8.44E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM51287
PNG
((3-aminophenazin-2-yl)amine | MLS001044416 | SMR00...)
Show SMILES Nc1cc2nc3ccccc3nc2cc1N
Show InChI InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2
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n/an/a 9.53E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM32001
PNG
(7-Oxo-7H-benzo[e]perimidine-4-carboxylic acid | 7-...)
Show SMILES OC(=O)c1ccc2C(=O)c3ccccc3-c3ncnc1c23
Show InChI InChI=1S/C16H8N2O3/c19-15-9-4-2-1-3-8(9)13-12-10(15)5-6-11(16(20)21)14(12)18-7-17-13/h1-7H,(H,20,21)
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n/an/a 9.78E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM51019
PNG
(4-methyl-7-benzo[a]phenalenone | 4-methyl-7H-benzo...)
Show SMILES Cc1ccc2C(=O)c3ccccc3-c3cccc1c23
Show InChI InChI=1S/C18H12O/c1-11-9-10-16-17-12(11)7-4-8-14(17)13-5-2-3-6-15(13)18(16)19/h2-10H,1H3
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n/an/a 1.01E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67441
PNG
(4-(3-methyl-1-pyridin-1-iumyl)-5-[[(4-nitrophenyl)...)
Show SMILES Cc1ccc[n+](c1)-c1[n-]c(=O)sc1CN=Nc1ccc(cc1)[N+]([O-])=O |w:15.17|
Show InChI InChI=1S/C16H13N5O3S/c1-11-3-2-8-20(10-11)15-14(25-16(22)18-15)9-17-19-12-4-6-13(7-5-12)21(23)24/h2-8,10H,9H2,1H3
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n/an/a 1.01E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67428
PNG
((E)-2-cyano-3-(2-nitrophenyl)-N-prop-2-enyl-2-prop...)
Show SMILES [O-][N+](=O)c1ccccc1\C=C(/C#N)C(=O)NCC=C
Show InChI InChI=1S/C13H11N3O3/c1-2-7-15-13(17)11(9-14)8-10-5-3-4-6-12(10)16(18)19/h2-6,8H,1,7H2,(H,15,17)/b11-8+
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n/an/a 1.04E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM50919
PNG
(2-methoxyethyl 4-amino-3-(2-methoxyethyl)-2-sulfan...)
Show SMILES COCCOC(=O)c1sc(=S)n(CCOC)c1N
Show InChI InChI=1S/C10H16N2O4S2/c1-14-4-3-12-8(11)7(18-10(12)17)9(13)16-6-5-15-2/h3-6,11H2,1-2H3
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n/an/a 1.11E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM52936
PNG
(1-(3,5-dimethylphenyl)-3-(6-methoxy-3-pyridinyl)ur...)
Show SMILES COc1ccc(NC(=O)Nc2cc(C)cc(C)c2)cn1
Show InChI InChI=1S/C15H17N3O2/c1-10-6-11(2)8-13(7-10)18-15(19)17-12-4-5-14(20-3)16-9-12/h4-9H,1-3H3,(H2,17,18,19)
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n/an/a 1.14E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM50926
PNG
(4,8-dimethylcyclopenta[c]quinolizine-1,2-dicarboxy...)
Show SMILES COC(=O)c1cc2c(C)cc3ccc(C)cn3c2c1C(=O)OC
Show InChI InChI=1S/C18H17NO4/c1-10-5-6-12-7-11(2)13-8-14(17(20)22-3)15(18(21)23-4)16(13)19(12)9-10/h5-9H,1-4H3
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n/an/a 1.22E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM82038
PNG
(Alloxazine | CAS_490-59-5 | CHEMBL68500 | NSC_9925...)
Show SMILES O=c1[nH]c2nc3ccccc3nc2c(=O)[nH]1
Show InChI InChI=1S/C10H6N4O2/c15-9-7-8(13-10(16)14-9)12-6-4-2-1-3-5(6)11-7/h1-4H,(H2,12,13,14,15,16)
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n/an/a 1.24E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67442
PNG
(3-hydroxy-1-phenalenone | 3-hydroxy-1H-phenalen-1-...)
Show SMILES O=C1CC(=O)c2cccc3cccc1c23
Show InChI InChI=1S/C13H8O2/c14-11-7-12(15)10-6-2-4-8-3-1-5-9(11)13(8)10/h1-6H,7H2
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n/an/a 1.39E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67444
PNG
(3-(benzenesulfonyl)-7-hydroxy-8-methyl-1-benzopyra...)
Show SMILES Cc1c(O)ccc2cc(c(=O)oc12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H12O5S/c1-10-13(17)8-7-11-9-14(16(18)21-15(10)11)22(19,20)12-5-3-2-4-6-12/h2-9,17H,1H3
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n/an/a 1.42E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM51234
PNG
(MLS001029970 | SMR000426980 | cid_1961333)
Show SMILES Cn1c2ccc(N3CCCCC3)c3C(=O)c4ccccc4-c(cc1=O)c23
Show InChI InChI=1S/C22H20N2O2/c1-23-17-9-10-18(24-11-5-2-6-12-24)21-20(17)16(13-19(23)25)14-7-3-4-8-15(14)22(21)26/h3-4,7-10,13H,2,5-6,11-12H2,1H3
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n/an/a 1.43E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM50757
PNG
(6-methoxy-2-(1-piperidinyl)-3-quinolinecarbonitril...)
Show SMILES COc1ccc2nc(N3CCCCC3)c(cc2c1)C#N
Show InChI InChI=1S/C16H17N3O/c1-20-14-5-6-15-12(10-14)9-13(11-17)16(18-15)19-7-3-2-4-8-19/h5-6,9-10H,2-4,7-8H2,1H3
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n/an/a 1.48E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67439
PNG
(MLS001044354 | N-(2-phenazinyl)acetamide | N-Phena...)
Show SMILES CC(=O)Nc1ccc2nc3ccccc3nc2c1
Show InChI InChI=1S/C14H11N3O/c1-9(18)15-10-6-7-13-14(8-10)17-12-5-3-2-4-11(12)16-13/h2-8H,1H3,(H,15,18)
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n/an/a 1.48E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67420
PNG
(1-(4-benzo[cd]indol-2-ylpiperazin-1-yl)ethanone | ...)
Show SMILES CC(=O)N1CCN(CC1)C1=Nc2cccc3cccc1c23 |t:10|
Show InChI InChI=1S/C17H17N3O/c1-12(21)19-8-10-20(11-9-19)17-14-6-2-4-13-5-3-7-15(18-17)16(13)14/h2-7H,8-11H2,1H3
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n/an/a 1.58E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67437
PNG
(2,5,8-trihydroxy-6-methoxy-2-methyl-3H-benzo[g][1]...)
Show SMILES COc1cc(O)cc2cc3OC(C)(O)CC(=O)c3c(O)c12
Show InChI InChI=1S/C15H14O6/c1-15(19)6-9(17)13-11(21-15)4-7-3-8(16)5-10(20-2)12(7)14(13)18/h3-5,16,18-19H,6H2,1-2H3
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n/an/a 1.62E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67452
PNG
(5-(4-acetylphenyl)-N-(6-methoxy-3-pyridinyl)-2-fur...)
Show SMILES COc1ccc(NC(=O)c2ccc(o2)-c2ccc(cc2)C(C)=O)cn1
Show InChI InChI=1S/C19H16N2O4/c1-12(22)13-3-5-14(6-4-13)16-8-9-17(25-16)19(23)21-15-7-10-18(24-2)20-11-15/h3-11H,1-2H3,(H,21,23)
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n/an/a 1.64E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM52859
PNG
((4Z)-2-ethyl-4-(2-thenylidene)-1,3-dihydrobenzo[b]...)
Show SMILES CCN1C\C(=C\c2cccs2)c2nc3ccccc3c(C(O)=O)c2C1
Show InChI InChI=1S/C20H18N2O2S/c1-2-22-11-13(10-14-6-5-9-25-14)19-16(12-22)18(20(23)24)15-7-3-4-8-17(15)21-19/h3-10H,2,11-12H2,1H3,(H,23,24)/b13-10-
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n/an/a 1.70E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM50503727
PNG
(CHEMBL4560686)
Show SMILES [H][C@]1(O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O)O[C@H](CNCc2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1N |r|
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
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n/an/a 1.70E+4n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...


Bioorg Med Chem Lett 29: 339-341 (2019)


Article DOI: 10.1016/j.bmcl.2018.11.004
BindingDB Entry DOI: 10.7270/Q2Z60S9X
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67434
PNG
(4-amino-2-(3-chlorobenzyl)isoindoline-1,3-quinone ...)
Show SMILES Nc1cccc2C(=O)N(Cc3cccc(Cl)c3)C(=O)c12
Show InChI InChI=1S/C15H11ClN2O2/c16-10-4-1-3-9(7-10)8-18-14(19)11-5-2-6-12(17)13(11)15(18)20/h1-7H,8,17H2
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n/an/a 1.79E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67436
PNG
(4-(2-benzo[cd]indolyl)-2,6-dimethylmorpholine | 4-...)
Show SMILES CC1CN(CC(C)O1)C1=Nc2cccc3cccc1c23 |t:9|
Show InChI InChI=1S/C17H18N2O/c1-11-9-19(10-12(2)20-11)17-14-7-3-5-13-6-4-8-15(18-17)16(13)14/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 1.82E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM51283
PNG
((1R,2R,3R,8aS)-6-Acetyl-3-carbamoyl-1-cyano-2-(4-f...)
Show SMILES COC(=O)[C@@]1(C#N)[C@@H]2C=CC(=CN2[C@H]([C@@H]1c1ccc(F)cc1)C(N)=O)C(C)=O |c:8,10|
Show InChI InChI=1S/C20H18FN3O4/c1-11(25)13-5-8-15-20(10-22,19(27)28-2)16(12-3-6-14(21)7-4-12)17(18(23)26)24(15)9-13/h3-9,15-17H,1-2H3,(H2,23,26)/t15-,16-,17+,20-/m0/s1
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n/an/a 1.83E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM50097336
PNG
(CHEMBL152397 | Pyrene-1-carboxylic acid [(4R,5S,6S...)
Show SMILES NC1CC(N)C(OC2OC(CNC(=O)c3ccc4ccc5cccc6ccc3c4c56)C(O)C(O)C2N)C(O)C1O
Show InChI InChI=1S/C29H34N4O7/c30-17-10-18(31)27(26(37)23(17)34)40-29-22(32)25(36)24(35)19(39-29)11-33-28(38)16-9-7-14-5-4-12-2-1-3-13-6-8-15(16)21(14)20(12)13/h1-9,17-19,22-27,29,34-37H,10-11,30-32H2,(H,33,38)
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n/an/a 1.90E+4n/an/an/an/an/an/a



Graduate School of Bioscience and Biotechnology

Curated by ChEMBL


Assay Description
Inhibitory activity against peptide binding to the Rev Response Element RNA IIB was determined


Bioorg Med Chem Lett 11: 591-4 (2001)


BindingDB Entry DOI: 10.7270/Q2G44QT9
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM50503726
PNG
(CHEMBL4483318)
Show SMILES [H][C@]1(O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O)O[C@H](CNCc2ccc(O)c(OC)c2)[C@@H](O)[C@H](O)[C@H]1N |r|
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
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n/an/a 1.90E+4n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...


Bioorg Med Chem Lett 29: 339-341 (2019)


Article DOI: 10.1016/j.bmcl.2018.11.004
BindingDB Entry DOI: 10.7270/Q2Z60S9X
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM50503720
PNG
(CHEMBL4583631)
Show SMILES [H][C@]1(O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O)O[C@H](CNCC)[C@@H](O)[C@H](O)[C@H]1N |r|
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
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n/an/a 1.90E+4n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Inhibition of [3H]Rev response element binding to HIV1 biotinylated-Rev protein expressed in Escherichia coli after 15 mins by scintillation proximit...


Bioorg Med Chem Lett 29: 339-341 (2019)


Article DOI: 10.1016/j.bmcl.2018.11.004
BindingDB Entry DOI: 10.7270/Q2Z60S9X
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM32120
PNG
(2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]m...)
Show SMILES COc1ccc(cc1)-c1nc(CS(=O)CC(=O)NCc2ccccn2)c(C)o1
Show InChI InChI=1S/C20H21N3O4S/c1-14-18(23-20(27-14)15-6-8-17(26-2)9-7-15)12-28(25)13-19(24)22-11-16-5-3-4-10-21-16/h3-10H,11-13H2,1-2H3,(H,22,24)
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n/an/a 1.94E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM67429
PNG
((1-methylbenzimidazol-2-yl)methyl-[4-[4-(p-tolyl)p...)
Show SMILES Cc1ccc(cc1)N1CCN(CC1)c1ccc(NCc2nc3ccccc3n2C)cc1
Show InChI InChI=1S/C26H29N5/c1-20-7-11-22(12-8-20)30-15-17-31(18-16-30)23-13-9-21(10-14-23)27-19-26-28-24-5-3-4-6-25(24)29(26)2/h3-14,27H,15-19H2,1-2H3
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n/an/a 1.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM32076
PNG
(1-ethyl-2-[(1-methylimidazol-2-yl)sulfanylmethyl]b...)
Show SMILES CCn1c(CSc2nccn2C)nc2cc(ccc12)C(O)=O
Show InChI InChI=1S/C15H16N4O2S/c1-3-19-12-5-4-10(14(20)21)8-11(12)17-13(19)9-22-15-16-6-7-18(15)2/h4-8H,3,9H2,1-2H3,(H,20,21)
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n/an/a 1.97E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM50755
PNG
(4-(3-Cyano-6-ethoxy-quinolin-2-yl)-[1,4]diazepane-...)
Show SMILES CCOc1ccc2nc(N3CCCN(CC3)C(=O)Nc3ccccc3C)c(cc2c1)C#N
Show InChI InChI=1S/C25H27N5O2/c1-3-32-21-9-10-23-19(16-21)15-20(17-26)24(27-23)29-11-6-12-30(14-13-29)25(31)28-22-8-5-4-7-18(22)2/h4-5,7-10,15-16H,3,6,11-14H2,1-2H3,(H,28,31)
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n/an/a 2.03E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29W0CZG
More data for this
Ligand-Target Pair
Protein Rev


(Human immunodeficiency virus 1)
BDBM8580
PNG
((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 |r|
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
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n/an/a 2.10E+4n/an/an/an/an/an/a



Graduate School of Bioscience and Biotechnology

Curated by ChEMBL


Assay Description
Inhibitory activity against peptide binding to the RRE RNA was determined


Bioorg Med Chem Lett 11: 591-4 (2001)


BindingDB Entry DOI: 10.7270/Q2G44QT9
More data for this
Ligand-Target Pair
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