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Compile Data Set for Download or QSAR

Found 1563 hits Enz. Inhib. hit(s) with Target = 'Ubiquitin-conjugating enzyme E2 N' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM46318
PNG
(2-amino-4-methyl-N'-(3,4,5-trimethoxybenzylide...)
Show SMILES COc1cc(C=NNC(=O)c2sc(N)nc2C)cc(OC)c1OC
Show InChI InChI=1S/C15H18N4O4S/c1-8-13(24-15(16)18-8)14(20)19-17-7-9-5-10(21-2)12(23-4)11(6-9)22-3/h5-7H,1-4H3,(H2,16,18)(H,19,20)
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n/an/a 386n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM46318
PNG
(2-amino-4-methyl-N'-(3,4,5-trimethoxybenzylide...)
Show SMILES COc1cc(C=NNC(=O)c2sc(N)nc2C)cc(OC)c1OC
Show InChI InChI=1S/C15H18N4O4S/c1-8-13(24-15(16)18-8)14(20)19-17-7-9-5-10(21-2)12(23-4)11(6-9)22-3/h5-7H,1-4H3,(H2,16,18)(H,19,20)
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n/an/a 477n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78633
PNG
(2-amino-4-methyl-N-(veratrylideneamino)thiazole-5-...)
Show SMILES COc1ccc(C=NNC(=O)c2sc(N)nc2C)cc1OC
Show InChI InChI=1S/C14H16N4O3S/c1-8-12(22-14(15)17-8)13(19)18-16-7-9-4-5-10(20-2)11(6-9)21-3/h4-7H,1-3H3,(H2,15,17)(H,18,19)
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n/an/a 507n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78669
PNG
(1-[(2-keto-5,7-dimethyl-indol-3-yl)amino]-3-(tetra...)
Show SMILES Cc1cc(C)c2=NC(=O)C(NNC(=S)NCC3CCCO3)=c2c1
Show InChI InChI=1S/C16H20N4O2S/c1-9-6-10(2)13-12(7-9)14(15(21)18-13)19-20-16(23)17-8-11-4-3-5-22-11/h6-7,11H,3-5,8H2,1-2H3,(H2,17,20,23)(H,18,19,21)
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n/an/a 509n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78633
PNG
(2-amino-4-methyl-N-(veratrylideneamino)thiazole-5-...)
Show SMILES COc1ccc(C=NNC(=O)c2sc(N)nc2C)cc1OC
Show InChI InChI=1S/C14H16N4O3S/c1-8-12(22-14(15)17-8)13(19)18-16-7-9-4-5-10(20-2)11(6-9)21-3/h4-7H,1-3H3,(H2,15,17)(H,18,19)
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n/an/a 548n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78849
PNG
(1-[(2-keto-5,7-dimethyl-indol-3-yl)amino]-3-(2-met...)
Show SMILES COCCNC(=S)NNC1=c2cc(C)cc(C)c2=NC1=O
Show InChI InChI=1S/C14H18N4O2S/c1-8-6-9(2)11-10(7-8)12(13(19)16-11)17-18-14(21)15-4-5-20-3/h6-7H,4-5H2,1-3H3,(H2,15,18,21)(H,16,17,19)
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n/an/a 561n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM72267
PNG
(1-(3-methylphenyl)-3-[(2-oxidanylideneindol-3-yl)a...)
Show SMILES Cc1cccc(NC(=S)NNC2=c3ccccc3=NC2=O)c1
Show InChI InChI=1S/C16H14N4OS/c1-10-5-4-6-11(9-10)17-16(22)20-19-14-12-7-2-3-8-13(12)18-15(14)21/h2-9H,1H3,(H2,17,20,22)(H,18,19,21)
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n/an/a 594n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78671
PNG
(1-[(2-keto-5-nitro-indol-3-yl)amino]-3-(tetrahydro...)
Show SMILES [O-][N+](=O)c1ccc2[N-]C(=O)C(=[NH+]NC(=S)NCC3CCCO3)c2c1
Show InChI InChI=1S/C14H15N5O4S/c20-13-12(10-6-8(19(21)22)3-4-11(10)16-13)17-18-14(24)15-7-9-2-1-5-23-9/h3-4,6,9H,1-2,5,7H2,(H3,15,16,17,18,20,24)
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n/an/a 664n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78673
PNG
(6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(1,5-dim...)
Show SMILES Cc1c(NC(=O)CCCCCN2C(=O)c3ccccc3C2=O)c(=O)n(-c2ccccc2)n1C
Show InChI InChI=1S/C25H26N4O4/c1-17-22(25(33)29(27(17)2)18-11-5-3-6-12-18)26-21(30)15-7-4-10-16-28-23(31)19-13-8-9-14-20(19)24(28)32/h3,5-6,8-9,11-14H,4,7,10,15-16H2,1-2H3,(H,26,30)
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n/an/a 709n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM52609
PNG
(1-(4-hydroxyphenyl)-3-[(2-ketoindol-3-yl)amino]thi...)
Show SMILES Oc1ccc(NC(=S)NNC2=c3ccccc3=NC2=O)cc1
Show InChI InChI=1S/C15H12N4O2S/c20-10-7-5-9(6-8-10)16-15(22)19-18-13-11-3-1-2-4-12(11)17-14(13)21/h1-8,20H,(H2,16,19,22)(H,17,18,21)
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n/an/a 763n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM66590
PNG
(MLS000660952 | N-[2-(4-phenyl-1-piperazinyl)ethyl]...)
Show SMILES O=C(NCCN1CCN(CC1)c1ccccc1)c1ccc2c3nc4ccccc4n3c(=S)[nH]c2c1
Show InChI InChI=1S/C27H26N6OS/c34-26(28-12-13-31-14-16-32(17-15-31)20-6-2-1-3-7-20)19-10-11-21-23(18-19)30-27(35)33-24-9-5-4-8-22(24)29-25(21)33/h1-11,18H,12-17H2,(H,28,34)(H,30,35)
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n/an/a 829n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM50073568
PNG
(6,7-Dimethoxy-2-piperazin-1-yl-quinazolin-4-ylamin...)
Show SMILES COc1cc2nc(nc(N)c2cc1OC)N1CCNCC1
Show InChI InChI=1S/C14H19N5O2/c1-20-11-7-9-10(8-12(11)21-2)17-14(18-13(9)15)19-5-3-16-4-6-19/h7-8,16H,3-6H2,1-2H3,(H2,15,17,18)
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n/an/a 873n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78619
PNG
(2-amino-N'-(2,3-dimethoxybenzylidene)-4-methyl...)
Show SMILES COc1cccc(C=NNC(=O)c2sc(N)nc2C)c1OC
Show InChI InChI=1S/C14H16N4O3S/c1-8-12(22-14(15)17-8)13(19)18-16-7-9-5-4-6-10(20-2)11(9)21-3/h4-7H,1-3H3,(H2,15,17)(H,18,19)
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n/an/a 947n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78619
PNG
(2-amino-N'-(2,3-dimethoxybenzylidene)-4-methyl...)
Show SMILES COc1cccc(C=NNC(=O)c2sc(N)nc2C)c1OC
Show InChI InChI=1S/C14H16N4O3S/c1-8-12(22-14(15)17-8)13(19)18-16-7-9-5-4-6-10(20-2)11(9)21-3/h4-7H,1-3H3,(H2,15,17)(H,18,19)
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n/an/a 965n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM63221
PNG
(1-[(2-ketoindol-3-yl)amino]-3-(tetrahydrofurfuryl)...)
Show SMILES O=C1N=c2ccccc2=C1NNC(=S)NCC1CCCO1
Show InChI InChI=1S/C14H16N4O2S/c19-13-12(10-5-1-2-6-11(10)16-13)17-18-14(21)15-8-9-4-3-7-20-9/h1-2,5-6,9H,3-4,7-8H2,(H2,15,18,21)(H,16,17,19)
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n/an/a 967n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78555
PNG
(6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[4-(p...)
Show SMILES O=C(CCCCCN1C(=O)c2ccccc2C1=O)Nc1ccc(cc1)S(=O)(=O)N1CCCCC1
Show InChI InChI=1S/C25H29N3O5S/c29-23(11-3-1-8-18-28-24(30)21-9-4-5-10-22(21)25(28)31)26-19-12-14-20(15-13-19)34(32,33)27-16-6-2-7-17-27/h4-5,9-10,12-15H,1-3,6-8,11,16-18H2,(H,26,29)
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n/an/a 982n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78808
PNG
(2-[4-[2-(4-fluorophenyl)sulfanylethyl]pyridin-1-iu...)
Show SMILES Fc1ccc(SCCc2cc[n+](CC(=O)c3ccccc3)cc2)cc1
Show InChI InChI=1S/C21H19FNOS/c22-19-6-8-20(9-7-19)25-15-12-17-10-13-23(14-11-17)16-21(24)18-4-2-1-3-5-18/h1-11,13-14H,12,15-16H2/q+1
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n/an/a 1.02E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM65630
PNG
(2-[[4-(diphenylamino)phenyl]methylideneamino]guani...)
Show SMILES NC(N)=NN=Cc1ccc(cc1)N(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C20H19N5/c21-20(22)24-23-15-16-11-13-19(14-12-16)25(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-15H,(H4,21,22,24)
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n/an/a 1.11E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78673
PNG
(6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(1,5-dim...)
Show SMILES Cc1c(NC(=O)CCCCCN2C(=O)c3ccccc3C2=O)c(=O)n(-c2ccccc2)n1C
Show InChI InChI=1S/C25H26N4O4/c1-17-22(25(33)29(27(17)2)18-11-5-3-6-12-18)26-21(30)15-7-4-10-16-28-23(31)19-13-8-9-14-20(19)24(28)32/h3,5-6,8-9,11-14H,4,7,10,15-16H2,1-2H3,(H,26,30)
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n/an/a 1.23E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78626
PNG
(2-Amino-4-methyl-thiazole-5-carboxylic acid (1H-in...)
Show SMILES Cc1nc(N)sc1C(=O)NN=Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C14H13N5OS/c1-8-12(21-14(15)18-8)13(20)19-17-7-9-6-16-11-5-3-2-4-10(9)11/h2-7,16H,1H3,(H2,15,18)(H,19,20)/b17-7+
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n/an/a 1.25E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM64465
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,7...)
Show SMILES COc1ccc(OC)c2sc(nc12)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C30H34N4O5S2/c1-32(2)17-7-18-34(30-31-27-25(38-3)14-15-26(39-4)28(27)40-30)29(35)22-10-12-24(13-11-22)41(36,37)33-19-16-21-8-5-6-9-23(21)20-33/h5-6,8-15H,7,16-20H2,1-4H3
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n/an/a 1.27E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78782
PNG
(4-[1-[(3-fluorophenyl)methyl]-2,4-bis(oxidanyliden...)
Show SMILES Fc1cccc(Cn2c3ccccc3c(=O)n(CCCC(=O)NC3CCN(Cc4ccccc4)CC3)c2=O)c1
Show InChI InChI=1S/C31H33FN4O3/c32-25-11-6-10-24(20-25)22-36-28-13-5-4-12-27(28)30(38)35(31(36)39)17-7-14-29(37)33-26-15-18-34(19-16-26)21-23-8-2-1-3-9-23/h1-6,8-13,20,26H,7,14-19,21-22H2,(H,33,37)
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n/an/a 1.31E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78543
PNG
(MLS000087827 | N-(2-methyl-4-oxidanylidene-quinazo...)
Show SMILES CCCOc1ccc(cc1)C(=O)Nn1c(C)nc2ccccc2c1=O
Show InChI InChI=1S/C19H19N3O3/c1-3-12-25-15-10-8-14(9-11-15)18(23)21-22-13(2)20-17-7-5-4-6-16(17)19(22)24/h4-11H,3,12H2,1-2H3,(H,21,23)
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n/an/a 1.32E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78626
PNG
(2-Amino-4-methyl-thiazole-5-carboxylic acid (1H-in...)
Show SMILES Cc1nc(N)sc1C(=O)NN=Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C14H13N5OS/c1-8-12(21-14(15)18-8)13(20)19-17-7-9-6-16-11-5-3-2-4-10(9)11/h2-7,16H,1H3,(H2,15,18)(H,19,20)/b17-7+
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n/an/a 1.33E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78555
PNG
(6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[4-(p...)
Show SMILES O=C(CCCCCN1C(=O)c2ccccc2C1=O)Nc1ccc(cc1)S(=O)(=O)N1CCCCC1
Show InChI InChI=1S/C25H29N3O5S/c29-23(11-3-1-8-18-28-24(30)21-9-4-5-10-22(21)25(28)31)26-19-12-14-20(15-13-19)34(32,33)27-16-6-2-7-17-27/h4-5,9-10,12-15H,1-3,6-8,11,16-18H2,(H,26,29)
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n/an/a 1.34E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM65651
PNG
(4-[(Z)-[4-(4-chlorobenzyl)-3-keto-1,4-benzoxazin-2...)
Show SMILES CN1CCN(CCCNC(=O)c2ccc(\C=C3/Oc4ccccc4N(Cc4ccc(Cl)cc4)C3=O)cc2)CC1
Show InChI InChI=1S/C31H33ClN4O3/c1-34-17-19-35(20-18-34)16-4-15-33-30(37)25-11-7-23(8-12-25)21-29-31(38)36(22-24-9-13-26(32)14-10-24)27-5-2-3-6-28(27)39-29/h2-3,5-14,21H,4,15-20,22H2,1H3,(H,33,37)/b29-21-
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n/an/a 1.35E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM79201
PNG
(IK-IR | MLS002153619 | SMR001230887 | cid_24978566)
Show SMILES CC[C@H](C)Cc1cn(nn1)[C@@H](CCCCN)C(=O)NCCCCCCCCCCC(=O)N1CCN(CC1)c1nc(NCCOCCOCCOCC#C)nc(n1)N1CCN(CC1)C(=O)CCCCCCCCCCNC(=O)[C@H](CCCN=C(N)N)n1cc(C[C@@H](C)CC)nn1
Show InChI InChI=1S/C68H120N20O7/c1-6-45-93-47-49-95-50-48-94-46-36-75-66-76-67(85-41-37-83(38-42-85)61(89)30-21-17-13-9-11-15-19-25-33-72-63(91)59(28-23-24-32-69)87-53-57(79-81-87)51-55(4)7-2)78-68(77-66)86-43-39-84(40-44-86)62(90)31-22-18-14-10-12-16-20-26-34-73-64(92)60(29-27-35-74-65(70)71)88-54-58(80-82-88)52-56(5)8-3/h1,53-56,59-60H,7-52,69H2,2-5H3,(H,72,91)(H,73,92)(H4,70,71,74)(H,75,76,77,78)/t55-,56-,59-,60-/m0/s1
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n/an/a 1.45E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78808
PNG
(2-[4-[2-(4-fluorophenyl)sulfanylethyl]pyridin-1-iu...)
Show SMILES Fc1ccc(SCCc2cc[n+](CC(=O)c3ccccc3)cc2)cc1
Show InChI InChI=1S/C21H19FNOS/c22-19-6-8-20(9-7-19)25-15-12-17-10-13-23(14-11-17)16-21(24)18-4-2-1-3-5-18/h1-11,13-14H,12,15-16H2/q+1
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n/an/a 1.46E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM79117
PNG
(2-[(2-keto-2-pyrrolidino-acetyl)amino]-5,5-dimethy...)
Show SMILES CC1(C)Cc2c(CO1)sc(NC(=O)C(=O)N1CCCC1)c2C(N)=O
Show InChI InChI=1S/C16H21N3O4S/c1-16(2)7-9-10(8-23-16)24-14(11(9)12(17)20)18-13(21)15(22)19-5-3-4-6-19/h3-8H2,1-2H3,(H2,17,20)(H,18,21)
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n/an/a 1.47E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78759
PNG
(6-amino-4-(4-hydroxy-3,5-dimethoxy-phenyl)-3-(2-th...)
Show SMILES COc1cc(cc(OC)c1O)C1C(C#N)C(=N)Oc2[nH]nc(-c3cccs3)c12
Show InChI InChI=1S/C19H16N4O4S/c1-25-11-6-9(7-12(26-2)17(11)24)14-10(8-20)18(21)27-19-15(14)16(22-23-19)13-4-3-5-28-13/h3-7,10,14,21,24H,1-2H3,(H,22,23)
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n/an/a 1.47E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM50073568
PNG
(6,7-Dimethoxy-2-piperazin-1-yl-quinazolin-4-ylamin...)
Show SMILES COc1cc2nc(nc(N)c2cc1OC)N1CCNCC1
Show InChI InChI=1S/C14H19N5O2/c1-20-11-7-9-10(8-12(11)21-2)17-14(18-13(9)15)19-5-3-16-4-6-19/h7-8,16H,3-6H2,1-2H3,(H2,15,17,18)
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n/an/a 1.50E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78899
PNG
(1-(2-methoxyethyl)-3-[(5-nitro-2-oxidanylidene-ind...)
Show SMILES COCCNC(=S)N[NH+]=C1C(=O)[N-]c2ccc(cc12)[N+]([O-])=O
Show InChI InChI=1S/C12H13N5O4S/c1-21-5-4-13-12(22)16-15-10-8-6-7(17(19)20)2-3-9(8)14-11(10)18/h2-3,6H,4-5H2,1H3,(H3,13,14,15,16,18,22)
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n/an/a 1.52E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78521
PNG
(2-[4-(5-Fluoro-2-methyl-benzoimidazol-1-yl)-piperi...)
Show SMILES COc1ccccc1NC(=O)CN1CCC(CC1)n1c(C)nc2cc(F)ccc12
Show InChI InChI=1S/C22H25FN4O2/c1-15-24-19-13-16(23)7-8-20(19)27(15)17-9-11-26(12-10-17)14-22(28)25-18-5-3-4-6-21(18)29-2/h3-8,13,17H,9-12,14H2,1-2H3,(H,25,28)
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n/an/a 1.53E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78543
PNG
(MLS000087827 | N-(2-methyl-4-oxidanylidene-quinazo...)
Show SMILES CCCOc1ccc(cc1)C(=O)Nn1c(C)nc2ccccc2c1=O
Show InChI InChI=1S/C19H19N3O3/c1-3-12-25-15-10-8-14(9-11-15)18(23)21-22-13(2)20-17-7-5-4-6-16(17)19(22)24/h4-11H,3,12H2,1-2H3,(H,21,23)
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n/an/a 1.55E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM64766
PNG
(MLS001239923 | N-({2-[(2,4-dimethylphenoxy)acetyl]...)
Show SMILES Cc1ccc(OCC(=O)NNC(=S)NC(=O)C2CC2)c(C)c1
Show InChI InChI=1S/C15H19N3O3S/c1-9-3-6-12(10(2)7-9)21-8-13(19)17-18-15(22)16-14(20)11-4-5-11/h3,6-7,11H,4-5,8H2,1-2H3,(H,17,19)(H2,16,18,20,22)
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n/an/a 1.59E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78805
PNG
(2-amino-4-methyl-N-(3-pyridinylmethylideneamino)-5...)
Show SMILES Cc1nc(N)sc1C(=O)NN=Cc1cccnc1
Show InChI InChI=1S/C11H11N5OS/c1-7-9(18-11(12)15-7)10(17)16-14-6-8-3-2-4-13-5-8/h2-6H,1H3,(H2,12,15)(H,16,17)
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n/an/a 1.68E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM79255
PNG
(MLS002153690 | RI-GK | SMR001231068 | cid_25162995)
Show SMILES CC[C@H](C)[C@@H](C(=O)NCCCCCCCCCCC(=O)N1CCN(CC1)c1nc(NCCOCCOCCOCC#C)nc(n1)N1CCN(CC1)C(=O)CCCCCCCCCCNC(=O)[C@H](CCCCN)n1cc(C)nn1)n1cc(CCCCN=C(N)N)nn1
Show InChI InChI=1S/C64H112N20O7/c1-5-44-89-46-48-91-49-47-90-45-35-71-62-72-63(81-40-36-79(37-41-81)56(85)29-19-15-11-7-9-13-17-24-32-68-59(87)55(28-21-23-31-65)83-50-53(4)75-77-83)74-64(73-62)82-42-38-80(39-43-82)57(86)30-20-16-12-8-10-14-18-25-33-69-60(88)58(52(3)6-2)84-51-54(76-78-84)27-22-26-34-70-61(66)67/h1,50-52,55,58H,6-49,65H2,2-4H3,(H,68,87)(H,69,88)(H4,66,67,70)(H,71,72,73,74)/t52-,55-,58-/m0/s1
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n/an/a 1.68E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM43864
PNG
(2-chloranyl-N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2...)
Show SMILES Clc1cc(ccc1C(=O)Nc1ccc(cc1)C1=NCCN1)C(=O)Nc1ccc(cc1)C1=NCCN1
Show InChI InChI=1S/C26H23ClN6O2/c27-22-15-18(25(34)32-19-6-1-16(2-7-19)23-28-11-12-29-23)5-10-21(22)26(35)33-20-8-3-17(4-9-20)24-30-13-14-31-24/h1-10,15H,11-14H2,(H,28,29)(H,30,31)(H,32,34)(H,33,35)
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n/an/a 1.70E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM59086
PNG
(1-[N'-[6-[[amino-[[N'-(2-ethylhexyl)amidino]amino]...)
Show SMILES CCCCC(CC)CN=C(N)NC(N)=NCCCCCCN=C(N)NC(N)=NCC(CC)CCCC
Show InChI InChI=1S/C26H56N10/c1-5-9-15-21(7-3)19-33-25(29)35-23(27)31-17-13-11-12-14-18-32-24(28)36-26(30)34-20-22(8-4)16-10-6-2/h21-22H,5-20H2,1-4H3,(H5,27,29,31,33,35)(H5,28,30,32,34,36)
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n/an/a 1.73E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM63221
PNG
(1-[(2-ketoindol-3-yl)amino]-3-(tetrahydrofurfuryl)...)
Show SMILES O=C1N=c2ccccc2=C1NNC(=S)NCC1CCCO1
Show InChI InChI=1S/C14H16N4O2S/c19-13-12(10-5-1-2-6-11(10)16-13)17-18-14(21)15-8-9-4-3-7-20-9/h1-2,5-6,9H,3-4,7-8H2,(H2,15,18,21)(H,16,17,19)
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n/an/a 1.73E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78521
PNG
(2-[4-(5-Fluoro-2-methyl-benzoimidazol-1-yl)-piperi...)
Show SMILES COc1ccccc1NC(=O)CN1CCC(CC1)n1c(C)nc2cc(F)ccc12
Show InChI InChI=1S/C22H25FN4O2/c1-15-24-19-13-16(23)7-8-20(19)27(15)17-9-11-26(12-10-17)14-22(28)25-18-5-3-4-6-21(18)29-2/h3-8,13,17H,9-12,14H2,1-2H3,(H,25,28)
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n/an/a 1.78E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM79040
PNG
(MLS001029195 | N-[[1-(3-chlorobenzyl)-4-piperidyl]...)
Show SMILES Clc1cccc(CN2CCC(CNC(=O)C3CCCN(C3)c3ncnc4n5CCCCCc5nc34)CC2)c1
Show InChI InChI=1S/C29H38ClN7O/c30-24-8-4-6-22(16-24)18-35-14-10-21(11-15-35)17-31-29(38)23-7-5-12-36(19-23)27-26-28(33-20-32-27)37-13-3-1-2-9-25(37)34-26/h4,6,8,16,20-21,23H,1-3,5,7,9-15,17-19H2,(H,31,38)
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n/an/a 1.89E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78805
PNG
(2-amino-4-methyl-N-(3-pyridinylmethylideneamino)-5...)
Show SMILES Cc1nc(N)sc1C(=O)NN=Cc1cccnc1
Show InChI InChI=1S/C11H11N5OS/c1-7-9(18-11(12)15-7)10(17)16-14-6-8-3-2-4-13-5-8/h2-6H,1H3,(H2,12,15)(H,16,17)
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n/an/a 1.89E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM59086
PNG
(1-[N'-[6-[[amino-[[N'-(2-ethylhexyl)amidino]amino]...)
Show SMILES CCCCC(CC)CN=C(N)NC(N)=NCCCCCCN=C(N)NC(N)=NCC(CC)CCCC
Show InChI InChI=1S/C26H56N10/c1-5-9-15-21(7-3)19-33-25(29)35-23(27)31-17-13-11-12-14-18-32-24(28)36-26(30)34-20-22(8-4)16-10-6-2/h21-22H,5-20H2,1-4H3,(H5,27,29,31,33,35)(H5,28,30,32,34,36)
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n/an/a 1.98E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78536
PNG
(4-(3-butyl-7-cyclopentyl-2,6-diketo-purin-8-yl)ben...)
Show SMILES CCCCn1c2nc(-c3ccc(cc3)C#N)n(C3CCCC3)c2c(=O)[nH]c1=O
Show InChI InChI=1S/C21H23N5O2/c1-2-3-12-25-19-17(20(27)24-21(25)28)26(16-6-4-5-7-16)18(23-19)15-10-8-14(13-22)9-11-15/h8-11,16H,2-7,12H2,1H3,(H,24,27,28)
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n/an/a 1.99E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM79201
PNG
(IK-IR | MLS002153619 | SMR001230887 | cid_24978566)
Show SMILES CC[C@H](C)Cc1cn(nn1)[C@@H](CCCCN)C(=O)NCCCCCCCCCCC(=O)N1CCN(CC1)c1nc(NCCOCCOCCOCC#C)nc(n1)N1CCN(CC1)C(=O)CCCCCCCCCCNC(=O)[C@H](CCCN=C(N)N)n1cc(C[C@@H](C)CC)nn1
Show InChI InChI=1S/C68H120N20O7/c1-6-45-93-47-49-95-50-48-94-46-36-75-66-76-67(85-41-37-83(38-42-85)61(89)30-21-17-13-9-11-15-19-25-33-72-63(91)59(28-23-24-32-69)87-53-57(79-81-87)51-55(4)7-2)78-68(77-66)86-43-39-84(40-44-86)62(90)31-22-18-14-10-12-16-20-26-34-73-64(92)60(29-27-35-74-65(70)71)88-54-58(80-82-88)52-56(5)8-3/h1,53-56,59-60H,7-52,69H2,2-5H3,(H,72,91)(H,73,92)(H4,70,71,74)(H,75,76,77,78)/t55-,56-,59-,60-/m0/s1
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n/an/a 2.01E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM51861
PNG
(IW-LK | MLS000562581 | SMR000391065 | cid_16196530)
Show SMILES Cl.CCC(C)[C@H](N)c1cn(nn1)[C@@H](Cc1cc2ccccc2[nH]1)C(=O)N1CCN(CC1)c1nc(NCCOCCOCCOCC#C)nc(n1)N1CCN(CC1)C(=O)[C@H](CCCCN)n1cc(nn1)[C@@H](N)CC(C)C
Show InChI InChI=1S/C51H78N18O5.ClH/c1-6-25-72-27-29-74-30-28-73-26-16-55-49-57-50(66-21-17-64(18-22-66)47(70)44(14-10-11-15-52)68-34-42(60-62-68)40(53)31-36(3)4)59-51(58-49)67-23-19-65(20-24-67)48(71)45(33-39-32-38-12-8-9-13-41(38)56-39)69-35-43(61-63-69)46(54)37(5)7-2;/h1,8-9,12-13,32,34-37,40,44-46,56H,7,10-11,14-31,33,52-54H2,2-5H3,(H,55,57,58,59);1H/t37?,40-,44-,45-,46-;/m0./s1
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n/an/a 2.07E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78848
PNG
(IK-LW | MLS000562543 | SMR000391070 | cid_16196648)
Show SMILES Cl.CCC(C)[C@H](N)c1cn(nn1)[C@@H](CCCCN)C(=O)N1CCN(CC1)c1nc(NCCOCCOCCOCC#C)nc(n1)N1CCN(CC1)C(=O)[C@H](Cc1cc2ccccc2[nH]1)n1cc(nn1)[C@@H](N)CC(C)C
Show InChI InChI=1S/C51H78N18O5.ClH/c1-6-25-72-27-29-74-30-28-73-26-16-55-49-57-50(66-21-17-64(18-22-66)47(70)44(14-10-11-15-52)68-35-43(61-63-68)46(54)37(5)7-2)59-51(58-49)67-23-19-65(20-24-67)48(71)45(33-39-32-38-12-8-9-13-41(38)56-39)69-34-42(60-62-69)40(53)31-36(3)4;/h1,8-9,12-13,32,34-37,40,44-46,56H,7,10-11,14-31,33,52-54H2,2-5H3,(H,55,57,58,59);1H/t37?,40-,44-,45-,46-;/m0./s1
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n/an/a 2.07E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM79255
PNG
(MLS002153690 | RI-GK | SMR001231068 | cid_25162995)
Show SMILES CC[C@H](C)[C@@H](C(=O)NCCCCCCCCCCC(=O)N1CCN(CC1)c1nc(NCCOCCOCCOCC#C)nc(n1)N1CCN(CC1)C(=O)CCCCCCCCCCNC(=O)[C@H](CCCCN)n1cc(C)nn1)n1cc(CCCCN=C(N)N)nn1
Show InChI InChI=1S/C64H112N20O7/c1-5-44-89-46-48-91-49-47-90-45-35-71-62-72-63(81-40-36-79(37-41-81)56(85)29-19-15-11-7-9-13-17-24-32-68-59(87)55(28-21-23-31-65)83-50-53(4)75-77-83)74-64(73-62)82-42-38-80(39-43-82)57(86)30-20-16-12-8-10-14-18-25-33-69-60(88)58(52(3)6-2)84-51-54(76-78-84)27-22-26-34-70-61(66)67/h1,50-52,55,58H,6-49,65H2,2-4H3,(H,68,87)(H,69,88)(H4,66,67,70)(H,71,72,73,74)/t52-,55-,58-/m0/s1
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n/an/a 2.11E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N


(Homo sapiens)
BDBM78782
PNG
(4-[1-[(3-fluorophenyl)methyl]-2,4-bis(oxidanyliden...)
Show SMILES Fc1cccc(Cn2c3ccccc3c(=O)n(CCCC(=O)NC3CCN(Cc4ccccc4)CC3)c2=O)c1
Show InChI InChI=1S/C31H33FN4O3/c32-25-11-6-10-24(20-25)22-36-28-13-5-4-12-27(28)30(38)35(31(36)39)17-7-14-29(37)33-26-15-18-34(19-16-26)21-23-8-2-1-3-9-23/h1-6,8-13,20,26H,7,14-19,21-22H2,(H,33,37)
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n/an/a 2.11E+3n/an/an/an/an/an/a



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 CA...


PubChem Bioassay (2011)

More data for this
Ligand-Target Pair
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