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Compile Data Set for Download or QSAR

Found 459 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 4597   
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
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM44137
PNG
(5-anilino-3H-1,3,4-thiadiazole-2-thione | 5-phenyl...)
Show SMILES Sc1nnc(Nc2ccccc2)s1
Show InChI InChI=1S/C8H7N3S2/c12-8-11-10-7(13-8)9-6-4-2-1-3-5-6/h1-5H,(H,9,10)(H,11,12)
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n/an/a 892n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM77703
PNG
(3-(3-chloranyl-1-benzothiophen-2-yl)-4-methyl-1H-1...)
Show SMILES Cn1c(n[nH]c1=S)-c1sc2ccccc2c1Cl
Show InChI InChI=1S/C11H8ClN3S2/c1-15-10(13-14-11(15)16)9-8(12)6-4-2-3-5-7(6)17-9/h2-5H,1H3,(H,14,16)
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n/an/a 936n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80140
PNG
(7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cy...)
Show SMILES S=c1[nH]nc2c3c4CCCCc4sc3ncn12
Show InChI InChI=1S/C11H10N4S2/c16-11-14-13-9-8-6-3-1-2-4-7(6)17-10(8)12-5-15(9)11/h5H,1-4H2,(H,14,16)
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n/an/a 992n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM59062
PNG
(4-(3-methylbutyl)-1-sulfanylidene-2H-[1,2,4]triazo...)
Show SMILES CC(C)CCn1c2n[nH]c(=S)n2c2ccccc2c1=O
Show InChI InChI=1S/C14H16N4OS/c1-9(2)7-8-17-12(19)10-5-3-4-6-11(10)18-13(17)15-16-14(18)20/h3-6,9H,7-8H2,1-2H3,(H,16,20)
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n/an/a 1.19E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM55750
PNG
(5-(2-phenylethylamino)-3H-1,3,4-thiadiazole-2-thio...)
Show SMILES Sc1nnc(NCCc2ccccc2)s1
Show InChI InChI=1S/C10H11N3S2/c14-10-13-12-9(15-10)11-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)
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n/an/a 1.20E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM38589
PNG
(5-(4-methylphenyl)-2H-[1,3]thiazolo[2,3-c][1,2,4]t...)
Show SMILES Cc1ccc(cc1)-c1csc2n[nH]c(=S)n12
Show InChI InChI=1S/C11H9N3S2/c1-7-2-4-8(5-3-7)9-6-16-11-13-12-10(15)14(9)11/h2-6H,1H3,(H,12,15)
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n/an/a 1.35E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM62590
PNG
(4-amino-3-(3-bromophenyl)-1H-1,2,4-triazole-5-thio...)
Show SMILES Nn1c(n[nH]c1=S)-c1cccc(Br)c1
Show InChI InChI=1S/C8H7BrN4S/c9-6-3-1-2-5(4-6)7-11-12-8(14)13(7)10/h1-4H,10H2,(H,12,14)
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n/an/a 1.45E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM59059
PNG
(4-amyl-1-thioxo-2H-[1,2,4]triazolo[4,3-a]quinazoli...)
Show SMILES CCCCCn1c2n[nH]c(=S)n2c2ccccc2c1=O
Show InChI InChI=1S/C14H16N4OS/c1-2-3-6-9-17-12(19)10-7-4-5-8-11(10)18-13(17)15-16-14(18)20/h4-5,7-8H,2-3,6,9H2,1H3,(H,16,20)
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n/an/a 1.47E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80300
PNG
(4-(4-bromophenyl)-3-(2-furanyl)-1H-1,2,4-triazole-...)
Show SMILES Brc1ccc(cc1)-n1c(n[nH]c1=S)-c1ccco1
Show InChI InChI=1S/C12H8BrN3OS/c13-8-3-5-9(6-4-8)16-11(14-15-12(16)18)10-2-1-7-17-10/h1-7H,(H,15,18)
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n/an/a 1.50E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80169
PNG
(3-(2-furanyl)-4-[(5-methyl-2-thiophenyl)methyliden...)
Show SMILES Cc1ccc(C=Nn2c(n[nH]c2=S)-c2ccco2)s1 |w:6.6|
Show InChI InChI=1S/C12H10N4OS2/c1-8-4-5-9(19-8)7-13-16-11(14-15-12(16)18)10-3-2-6-17-10/h2-7H,1H3,(H,15,18)/b13-7+
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n/an/a 1.55E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM60611
PNG
((4E)-2-methoxy-4-[[[3-(1,4,5,6-tetrahydrocyclopent...)
Show SMILES COc1cc(C=Nn2c(n[nH]c2=S)-c2n[nH]c3CCCc23)ccc1O |w:6.6|
Show InChI InChI=1S/C16H14N6O2S/c1-24-13-7-9(5-6-12(13)23)8-17-22-15(20-21-16(22)25)14-10-3-2-4-11(10)18-19-14/h5-8,23H,2-4H2,1H3/b15-14+,17-8?
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n/an/a 1.56E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM59063
PNG
(4-butyl-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]q...)
Show SMILES CCCCn1c2n[nH]c(=S)n2c2ccccc2c1=O
Show InChI InChI=1S/C13H14N4OS/c1-2-3-8-16-11(18)9-6-4-5-7-10(9)17-12(16)14-15-13(17)19/h4-7H,2-3,8H2,1H3,(H,15,19)
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n/an/a 1.70E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80156
PNG
(4-[(1-methyl-2-pyrrolyl)methylideneamino]-3-phenyl...)
Show SMILES Cn1cccc1C=Nn1c(n[nH]c1=S)-c1ccccc1 |w:7.8|
Show InChI InChI=1S/C14H13N5S/c1-18-9-5-8-12(18)10-15-19-13(16-17-14(19)20)11-6-3-2-4-7-11/h2-10H,1H3,(H,17,20)/b15-10+
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n/an/a 1.78E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80153
PNG
(3-(2-furanyl)-4-[(3-methyl-2-thiophenyl)methyliden...)
Show SMILES Cc1ccsc1C=Nn1c(n[nH]c1=S)-c1ccco1 |w:7.8|
Show InChI InChI=1S/C12H10N4OS2/c1-8-4-6-19-10(8)7-13-16-11(14-15-12(16)18)9-3-2-5-17-9/h2-7H,1H3,(H,15,18)/b13-7+
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n/an/a 1.79E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM60610
PNG
(2,6-dimethoxy-4-[[[3-(1,4,5,6-tetrahydrocyclopenta...)
Show SMILES COc1cc(C=Nn2c(n[nH]c2=S)-c2n[nH]c3CCCc23)cc(OC)c1O |w:6.6|
Show InChI InChI=1S/C17H16N6O3S/c1-25-12-6-9(7-13(26-2)15(12)24)8-18-23-16(21-22-17(23)27)14-10-4-3-5-11(10)19-20-14/h6-8,24H,3-5H2,1-2H3/b16-14+,18-8?
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n/an/a 1.81E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM65113
PNG
(3-phenyl-4-(2-thenylideneamino)-1H-1,2,4-triazole-...)
Show SMILES S=c1[nH]nc(-c2ccccc2)n1N=Cc1cccs1 |w:12.13|
Show InChI InChI=1S/C13H10N4S2/c18-13-16-15-12(10-5-2-1-3-6-10)17(13)14-9-11-7-4-8-19-11/h1-9H,(H,16,18)/b14-9+
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n/an/a 1.81E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80143
PNG
(4-methyl-3-[1-methyl-3-(trifluoromethyl)-5-thieno[...)
Show SMILES Cn1nc(c2cc(sc12)-c1n[nH]c(=S)n1C)C(F)(F)F
Show InChI InChI=1S/C10H8F3N5S2/c1-17-7(14-15-9(17)19)5-3-4-6(10(11,12)13)16-18(2)8(4)20-5/h3H,1-2H3,(H,15,19)
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n/an/a 1.84E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80145
PNG
(4-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-3...)
Show SMILES [O-][N+](=O)c1cc2OCOc2cc1[CH+][N-]n1c(n[nH]c1=S)-c1ccccc1
Show InChI InChI=1S/C16H11N5O4S/c22-21(23)12-7-14-13(24-9-25-14)6-11(12)8-17-20-15(18-19-16(20)26)10-4-2-1-3-5-10/h1-8H,9H2,(H,19,26)
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n/an/a 1.89E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80258
PNG
(4-[(E)-3-Furan-2-yl-2-methyl-prop-2-en-(E)-ylidene...)
Show SMILES CC(C=Nn1c(n[nH]c1=S)-c1cccnc1)=Cc1ccco1 |w:3.3,16.18|
Show InChI InChI=1S/C15H13N5OS/c1-11(8-13-5-3-7-21-13)9-17-20-14(18-19-15(20)22)12-4-2-6-16-10-12/h2-10H,1H3,(H,19,22)/b11-8+,17-9+
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n/an/a 1.93E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM46661
PNG
(5-(4-methoxyphenyl)-1,2-dihydro-1,2,4-triazole-3-t...)
Show SMILES COc1ccc(cc1)-c1n[nH]c(=S)[nH]1
Show InChI InChI=1S/C9H9N3OS/c1-13-7-4-2-6(3-5-7)8-10-9(14)12-11-8/h2-5H,1H3,(H2,10,11,12,14)
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n/an/a 1.95E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80315
PNG
(2-[methyl(8-quinolinylsulfonyl)amino]-N-(2-sulfany...)
Show SMILES CN(CC(=O)Nc1nnc(S)s1)S(=O)(=O)c1cccc2cccnc12
Show InChI InChI=1S/C14H13N5O3S3/c1-19(8-11(20)16-13-17-18-14(23)24-13)25(21,22)10-6-2-4-9-5-3-7-15-12(9)10/h2-7H,8H2,1H3,(H,18,23)(H,16,17,20)
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n/an/a 1.95E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80142
PNG
(6-Bromo-5-methyl-1H-imidazo[4,5-b]pyridine-2-thiol...)
Show SMILES Cc1nc2[nH]c(=S)[nH]c2cc1Br
Show InChI InChI=1S/C7H4BrN3S/c1-3-4(8)2-5-6(9-3)11-7(12)10-5/h2H,1H3
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n/an/a 1.98E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80178
PNG
(4-[(5-methyl-2-thienyl)methyleneamino]-3-(3-pyridy...)
Show SMILES Cc1ccc(C=Nn2c(n[nH]c2=S)-c2cccnc2)s1 |w:6.6|
Show InChI InChI=1S/C13H11N5S2/c1-9-4-5-11(20-9)8-15-18-12(16-17-13(18)19)10-3-2-6-14-7-10/h2-8H,1H3,(H,17,19)/b15-8+
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n/an/a 2.00E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80257
PNG
(4-(benzalamino)-3-(3-pyridyl)-1H-1,2,4-triazole-5-...)
Show SMILES S=c1[nH]nc(-c2cccnc2)n1N=Cc1ccccc1 |w:12.13|
Show InChI InChI=1S/C14H11N5S/c20-14-18-17-13(12-7-4-8-15-10-12)19(14)16-9-11-5-2-1-3-6-11/h1-10H,(H,18,20)/b16-9+
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n/an/a 2.02E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80275
PNG
(4-(2-furanylmethylideneamino)-3-(3-methylphenyl)-1...)
Show SMILES Cc1cccc(c1)-c1n[nH]c(=S)n1N=Cc1ccco1 |w:13.14|
Show InChI InChI=1S/C14H12N4OS/c1-10-4-2-5-11(8-10)13-16-17-14(20)18(13)15-9-12-6-3-7-19-12/h2-9H,1H3,(H,17,20)/b15-9+
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n/an/a 2.10E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM59053
PNG
((4Z)-2-hydroxy-4-[[[3-(phenoxymethyl)-5-sulfanylid...)
Show SMILES Oc1ccc(C=Nn2c(COc3ccccc3)n[nH]c2=S)cc1O |w:6.6|
Show InChI InChI=1S/C16H14N4O3S/c21-13-7-6-11(8-14(13)22)9-17-20-15(18-19-16(20)24)10-23-12-4-2-1-3-5-12/h1-9,21-22H,10H2,(H,19,24)
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n/an/a 2.10E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80274
PNG
(4-[(5-methyl-2-thienyl)methyleneamino]-3-(4-pyridy...)
Show SMILES Cc1ccc(C=Nn2c(n[nH]c2=S)-c2ccncc2)s1 |w:6.6|
Show InChI InChI=1S/C13H11N5S2/c1-9-2-3-11(20-9)8-15-18-12(16-17-13(18)19)10-4-6-14-7-5-10/h2-8H,1H3,(H,17,19)/b15-8+
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n/an/a 2.17E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM34523
PNG
(8-(2-chlorophenyl)-3-(4-ethoxyphenyl)-6-oxidanylid...)
Show SMILES CCOc1ccc(cc1)N1CSC2=C(C#N)C(CC(=O)N2C1)c1ccccc1Cl |c:13|
Show InChI InChI=1S/C22H20ClN3O2S/c1-2-28-16-9-7-15(8-10-16)25-13-26-21(27)11-18(17-5-3-4-6-20(17)23)19(12-24)22(26)29-14-25/h3-10,18H,2,11,13-14H2,1H3
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n/an/a 2.18E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80227
PNG
(3-(7-methoxy-1-benzofuran-2-yl)-4-methyl-1H-1,2,4-...)
Show SMILES COc1cccc2cc(oc12)-c1n[nH]c(=S)n1C
Show InChI InChI=1S/C12H11N3O2S/c1-15-11(13-14-12(15)18)9-6-7-4-3-5-8(16-2)10(7)17-9/h3-6H,1-2H3,(H,14,18)
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n/an/a 2.18E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80312
PNG
((4Z)-2-bromanyl-6-methoxy-4-[[[3-(phenoxymethyl)-5...)
Show SMILES COc1cc(C=Nn2c(COc3ccccc3)n[nH]c2=S)cc(Br)c1O |w:6.6|
Show InChI InChI=1S/C17H15BrN4O3S/c1-24-14-8-11(7-13(18)16(14)23)9-19-22-15(20-21-17(22)26)10-25-12-5-3-2-4-6-12/h2-9,23H,10H2,1H3,(H,21,26)/b19-9+
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n/an/a 2.19E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80141
PNG
(2-Mercapto-4-pyridin-4-yl-5,6,7,8-tetrahydro-quino...)
Show SMILES S=c1[nH]c2CCCCc2c(-c2ccncc2)c1C#N
Show InChI InChI=1S/C15H13N3S/c16-9-12-14(10-5-7-17-8-6-10)11-3-1-2-4-13(11)18-15(12)19/h5-8H,1-4H2,(H,18,19)
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n/an/a 2.21E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80197
PNG
(4-[[(E)-3-(2-methoxyphenyl)prop-2-enylidene]amino]...)
Show SMILES COc1ccccc1C=CC=Nn1c(n[nH]c1=S)-c1ccncc1 |w:11.12,8.8|
Show InChI InChI=1S/C17H15N5OS/c1-23-15-7-3-2-5-13(15)6-4-10-19-22-16(20-21-17(22)24)14-8-11-18-12-9-14/h2-12H,1H3,(H,21,24)/b6-4+,19-10+
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n/an/a 2.21E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80216
PNG
(3-cyclohexyl-4-(2-pyridinylmethylideneamino)-1H-1,...)
Show SMILES S=c1[nH]nc(C2CCCCC2)n1N=Cc1ccccn1 |w:12.13|
Show InChI InChI=1S/C14H17N5S/c20-14-18-17-13(11-6-2-1-3-7-11)19(14)16-10-12-8-4-5-9-15-12/h4-5,8-11H,1-3,6-7H2,(H,18,20)/b16-10+
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n/an/a 2.23E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM61876
PNG
(3-[(2-nitrophenyl)sulfanylmethyl]-4-prop-2-enyl-1H...)
Show SMILES [O-][N+](=O)c1ccccc1SCc1n[nH]c(=S)n1CC=C
Show InChI InChI=1S/C12H12N4O2S2/c1-2-7-15-11(13-14-12(15)19)8-20-10-6-4-3-5-9(10)16(17)18/h2-6H,1,7-8H2,(H,14,19)
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n/an/a 2.24E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80162
PNG
(3-(5-methyl-1H-pyrazol-3-yl)-4-[(5-methyl-2-thieny...)
Show SMILES Cc1cc(n[nH]1)-c1n[nH]c(=S)n1N=Cc1ccc(C)s1 |w:12.13|
Show InChI InChI=1S/C12H10N6S2/c1-7-5-10(15-14-7)11-16-17-12(19)18(11)13-6-9-4-3-8(2)20-9/h3-6H,1-2H3/b11-10+,13-6?
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n/an/a 2.28E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM60766
PNG
(4-[(E)-3-Furan-2-yl-2-methyl-prop-2-en-(E)-ylidene...)
Show SMILES CC(C=Nn1c(n[nH]c1=S)-c1n[nH]c2CCCc12)=Cc1ccco1 |w:3.3,18.21|
Show InChI InChI=1S/C16H14N6OS/c1-10(8-11-4-3-7-23-11)9-17-22-15(20-21-16(22)24)14-12-5-2-6-13(12)18-19-14/h3-4,7-9H,2,5-6H2,1H3/b10-8?,15-14+,17-9?
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n/an/a 2.29E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80180
PNG
(4-[(4-nitrobenzylidene)amino]-3-(3-pyridyl)-1H-1,2...)
Show SMILES [O-][N+](=O)c1ccc([CH+][N-]n2c(n[nH]c2=S)-c2cccnc2)cc1
Show InChI InChI=1S/C14H10N6O2S/c21-20(22)12-5-3-10(4-6-12)8-16-19-13(17-18-14(19)23)11-2-1-7-15-9-11/h1-9H,(H,18,23)
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n/an/a 2.30E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM34323
PNG
(MLS000081951 | N-(2-besyl-3,6-dihydrothiazin-1-yli...)
Show SMILES O=S(=O)(NS1=CC=CCN1S(=O)(=O)c1ccccc1)c1ccccc1 |c:6,t:4|
Show InChI InChI=1S/C16H16N2O4S3/c19-24(20,15-9-3-1-4-10-15)17-23-14-8-7-13-18(23)25(21,22)16-11-5-2-6-12-16/h1-12,14,17H,13H2
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n/an/a 2.32E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM51976
PNG
(4-[(2-methyl-3-phenyl-2-propen-1-ylidene)amino]-5-...)
Show SMILES CC(C=Nn1c(n[nH]c1=S)-c1ccncc1)=Cc1ccccc1 |w:3.3,16.18|
Show InChI InChI=1S/C17H15N5S/c1-13(11-14-5-3-2-4-6-14)12-19-22-16(20-21-17(22)23)15-7-9-18-10-8-15/h2-12H,1H3,(H,21,23)
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n/an/a 2.33E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80158
PNG
(4-[(3-nitrobenzylidene)amino]-3-(3-pyridyl)-1H-1,2...)
Show SMILES [O-][N+](=O)c1cccc([CH+][N-]n2c(n[nH]c2=S)-c2cccnc2)c1
Show InChI InChI=1S/C14H10N6O2S/c21-20(22)12-5-1-3-10(7-12)8-16-19-13(17-18-14(19)23)11-4-2-6-15-9-11/h1-9H,(H,18,23)
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n/an/a 2.33E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80177
PNG
(4-[(E)-3-Phenyl-prop-2-en-(E)-ylideneamino]-5-pyri...)
Show SMILES S=c1[nH]nc(-c2cccnc2)n1N=CC=Cc1ccccc1 |w:12.13,15.17|
Show InChI InChI=1S/C16H13N5S/c22-16-20-19-15(14-9-5-10-17-12-14)21(16)18-11-4-8-13-6-2-1-3-7-13/h1-12H,(H,20,22)/b8-4+,18-11+
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n/an/a 2.33E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80161
PNG
(3-(5-methyl-1H-pyrazol-3-yl)-4-[[(E)-3-phenylprop-...)
Show SMILES Cc1cc(n[nH]1)-c1n[nH]c(=S)n1N=CC=Cc1ccccc1 |w:12.13,15.17|
Show InChI InChI=1S/C15H12N6S/c1-11-10-13(18-17-11)14-19-20-15(22)21(14)16-9-5-8-12-6-3-2-4-7-12/h2-10H,1H3/b8-5?,14-13+,16-9?
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n/an/a 2.35E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80185
PNG
(4-(1-naphthalenylmethylideneamino)-3-(2-pyridinyl)...)
Show SMILES S=c1[nH]nc(-c2ccccn2)n1N=Cc1cccc2ccccc12 |w:12.13|
Show InChI InChI=1S/C18H13N5S/c24-18-22-21-17(16-10-3-4-11-19-16)23(18)20-12-14-8-5-7-13-6-1-2-9-15(13)14/h1-12H,(H,22,24)/b20-12+
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n/an/a 2.35E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM15236
PNG
(3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chr...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,16-20,22H
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n/an/a 2.39E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80304
PNG
((1Z)-1-[[(3-methyl-5-sulfanylidene-1H-1,2,4-triazo...)
Show SMILES Cc1n[nH]c(=S)n1N=Cc1c(O)ccc2ccccc12 |w:7.7|
Show InChI InChI=1S/C14H12N4OS/c1-9-16-17-14(20)18(9)15-8-12-11-5-3-2-4-10(11)6-7-13(12)19/h2-8,19H,1H3,(H,17,20)/b15-8+
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n/an/a 2.42E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM60691
PNG
(2-(2-keto-1,3-benzoxazol-3-yl)-N-(2-thioxo-3H-1,3,...)
Show SMILES Sc1nnc(NC(=O)Cn2c3ccccc3oc2=O)s1
Show InChI InChI=1S/C11H8N4O3S2/c16-8(12-9-13-14-10(19)20-9)5-15-6-3-1-2-4-7(6)18-11(15)17/h1-4H,5H2,(H,14,19)(H,12,13,16)
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n/an/a 2.44E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80160
PNG
(3-(5-methyl-1H-pyrazol-3-yl)-4-[(3-methyl-2-thieny...)
Show SMILES Cc1cc(n[nH]1)-c1n[nH]c(=S)n1N=Cc1sccc1C |w:12.13|
Show InChI InChI=1S/C12H10N6S2/c1-7-3-4-20-10(7)6-13-18-11(16-17-12(18)19)9-5-8(2)14-15-9/h3-6H,1-2H3/b11-9+,13-6?
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n/an/a 2.44E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80196
PNG
(4-[(3-methyl-2-thienyl)methyleneamino]-3-(4-pyridy...)
Show SMILES Cc1ccsc1C=Nn1c(n[nH]c1=S)-c1ccncc1 |w:7.8|
Show InChI InChI=1S/C13H11N5S2/c1-9-4-7-20-11(9)8-15-18-12(16-17-13(18)19)10-2-5-14-6-3-10/h2-8H,1H3,(H,17,19)/b15-8+
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n/an/a 2.45E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80259
PNG
(4-[(E)-3-Furan-2-yl-2-methyl-prop-2-en-(E)-ylidene...)
Show SMILES CC(C=Nn1c(n[nH]c1=S)-c1cc(C)[nH]n1)=Cc1ccco1 |w:3.3,16.18|
Show InChI InChI=1S/C14H12N6OS/c1-9(6-11-4-3-5-21-11)8-15-20-13(18-19-14(20)22)12-7-10(2)16-17-12/h3-8H,1-2H3/b9-6?,13-12+,15-8?
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n/an/a 2.47E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80165
PNG
((6E)-2-methoxy-6-[[[3-(1,4,5,6-tetrahydrocyclopent...)
Show SMILES COc1cccc(C=Nn2c(n[nH]c2=S)-c2n[nH]c3CCCc23)c1O |w:8.8|
Show InChI InChI=1S/C16H14N6O2S/c1-24-12-7-2-4-9(14(12)23)8-17-22-15(20-21-16(22)25)13-10-5-3-6-11(10)18-19-13/h2,4,7-8,23H,3,5-6H2,1H3/b15-13+,17-8?
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n/an/a 2.48E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2HQ3XD6
More data for this
Ligand-Target Pair
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