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PubChem AID 504657

Compile data set for download or QSAR
Found 53 hits of Enzyme Inhibition Constant Data   
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
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77724
PNG
(MLS000592149 | N-[(5-nitro-2-thienyl)methyleneamin...)
Show SMILES [O-][N+](=O)c1ccc(\C=N\NC(=O)c2cccnc2)s1
Show InChI InChI=1S/C11H8N4O3S/c16-11(8-2-1-5-12-6-8)14-13-7-9-3-4-10(19-9)15(17)18/h1-7H,(H,14,16)/b13-7+
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n/an/a 7.01E+4n/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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77698
PNG
((3Z)-3-(dimethylaminomethylene)-5-phenyl-furan-2-o...)
Show SMILES CN(C)\C=C1\C=C(OC1=O)c1ccccc1
Show InChI InChI=1S/C13H13NO2/c1-14(2)9-11-8-12(16-13(11)15)10-6-4-3-5-7-10/h3-9H,1-2H3/b11-9-
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n/an/a 9.41E+4n/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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77794
PNG
(4-(benzalamino)-6-tert-butyl-3-(methylthio)-1,2,4-...)
Show SMILES CSc1nnc(c(=O)n1N=Cc1ccccc1)C(C)(C)C
Show InChI InChI=1S/C15H18N4OS/c1-15(2,3)12-13(20)19(14(21-4)18-17-12)16-10-11-8-6-5-7-9-11/h5-10H,1-4H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM53447
PNG
(4,4'-[1,4-phenylenebis(oxy)]diphenol | 4-[4-(4...)
Show SMILES Oc1ccc(Oc2ccc(Oc3ccc(O)cc3)cc2)cc1
Show InChI InChI=1S/C18H14O4/c19-13-1-5-15(6-2-13)21-17-9-11-18(12-10-17)22-16-7-3-14(20)4-8-16/h1-12,19-20H
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77653
PNG
(3-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]ch...)
Show SMILES Cc1cc(C)nc(SCC(=O)c2cc3ccccc3oc2=O)n1
Show InChI InChI=1S/C17H14N2O3S/c1-10-7-11(2)19-17(18-10)23-9-14(20)13-8-12-5-3-4-6-15(12)22-16(13)21/h3-8H,9H2,1-2H3
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n/an/a>1.00E+5n/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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77014
PNG
(MLS000088012 | N-(1,3-benzothiazol-2-yl)-1-(4-chlo...)
Show SMILES Clc1ccc(cc1)S(=O)(=O)N1CCCC1C(=O)Nc1nc2ccccc2s1
Show InChI InChI=1S/C18H16ClN3O3S2/c19-12-7-9-13(10-8-12)27(24,25)22-11-3-5-15(22)17(23)21-18-20-14-4-1-2-6-16(14)26-18/h1-2,4,6-10,15H,3,5,11H2,(H,20,21,23)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM41029
PNG
(1-adamantyl-(3-amino-6-methyl-7,8-dihydro-5H-thien...)
Show SMILES CN1CCc2nc3sc(C(=O)C45CC6CC(CC(C6)C4)C5)c(N)c3cc2C1
Show InChI InChI=1S/C22H27N3OS/c1-25-3-2-17-15(11-25)7-16-18(23)19(27-21(16)24-17)20(26)22-8-12-4-13(9-22)6-14(5-12)10-22/h7,12-14H,2-6,8-11,23H2,1H3
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n/an/a>1.00E+5n/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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77709
PNG
(2-(trichloromethyl)-4-benzo[h][1]benzopyranone | 2...)
Show SMILES ClC(Cl)(Cl)c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C14H7Cl3O2/c15-14(16,17)12-7-11(18)10-6-5-8-3-1-2-4-9(8)13(10)19-12/h1-7H
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77775
PNG
(MLS000712057 | N-(4-imidazo[1,2-a]pyridin-2-ylphen...)
Show SMILES O=C(Nc1ccc(cc1)-c1cn2ccccc2n1)c1cccs1
Show InChI InChI=1S/C18H13N3OS/c22-18(16-4-3-11-23-16)19-14-8-6-13(7-9-14)15-12-21-10-2-1-5-17(21)20-15/h1-12H,(H,19,22)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77888
PNG
(3,7-dimethyl-5-oxidanylidene-N-[4-(trifluoromethyl...)
Show SMILES Cc1csc2nc(C)c(c(=O)n12)S(=O)(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C15H12F3N3O4S2/c1-8-7-26-14-19-9(2)12(13(22)21(8)14)27(23,24)20-10-3-5-11(6-4-10)25-15(16,17)18/h3-7,20H,1-2H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77668
PNG
((4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-...)
Show SMILES CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)OCn1nnc2ccccc2c1=O
Show InChI InChI=1S/C19H20N4O5S/c1-3-22(4-2)29(26,27)15-11-9-14(10-12-15)19(25)28-13-23-18(24)16-7-5-6-8-17(16)20-21-23/h5-12H,3-4,13H2,1-2H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77785
PNG
(2-chloranyl-N-[3-(4-methylphenyl)-1-phenyl-pyrazol...)
Show SMILES Cc1ccc(cc1)-c1nn(cc1NC(=O)CCl)-c1ccccc1
Show InChI InChI=1S/C18H16ClN3O/c1-13-7-9-14(10-8-13)18-16(20-17(23)11-19)12-22(21-18)15-5-3-2-4-6-15/h2-10,12H,11H2,1H3,(H,20,23)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77793
PNG
((2-Pyridin-3-yl-quinazolin-4-yl)-p-tolyl-amine | M...)
Show SMILES Cc1ccc(Nc2nc(nc3ccccc23)-c2cccnc2)cc1
Show InChI InChI=1S/C20H16N4/c1-14-8-10-16(11-9-14)22-20-17-6-2-3-7-18(17)23-19(24-20)15-5-4-12-21-13-15/h2-13H,1H3,(H,22,23,24)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77795
PNG
((E)-3-(4-Chloro-phenyl)-2-cyano-N-pyridin-3-yl-acr...)
Show SMILES Clc1ccc(\C=C(/C#N)C(=O)Nc2cccnc2)cc1
Show InChI InChI=1S/C15H10ClN3O/c16-13-5-3-11(4-6-13)8-12(9-17)15(20)19-14-2-1-7-18-10-14/h1-8,10H,(H,19,20)/b12-8+
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77817
PNG
((E)-3-(2-chlorophenyl)-N-phenyl-2-propenamide | (E...)
Show SMILES Clc1ccccc1\C=C\C(=O)Nc1ccccc1
Show InChI InChI=1S/C15H12ClNO/c16-14-9-5-4-6-12(14)10-11-15(18)17-13-7-2-1-3-8-13/h1-11H,(H,17,18)/b11-10+
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM69577
PNG
(MLS000859072 | N-(5-phenyl-1H-pyrazol-3-yl)benzami...)
Show SMILES O=C(Nc1cc(n[nH]1)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C16H13N3O/c20-16(13-9-5-2-6-10-13)17-15-11-14(18-19-15)12-7-3-1-4-8-12/h1-11H,(H2,17,18,19,20)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77858
PNG
(1-Ethyl-2-[4-(4-methoxy-benzenesulfonyl)-piperazin...)
Show SMILES CCn1c(nc2ccccc12)N1CCN(CC1)S(=O)(=O)c1ccc(OC)cc1
Show InChI InChI=1S/C20H24N4O3S/c1-3-24-19-7-5-4-6-18(19)21-20(24)22-12-14-23(15-13-22)28(25,26)17-10-8-16(27-2)9-11-17/h4-11H,3,12-15H2,1-2H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77887
PNG
(3,7-dimethyl-N-(4-morpholin-4-ylphenyl)-5-oxidanyl...)
Show SMILES Cc1csc2nc(C)c(c(=O)n12)S(=O)(=O)Nc1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C18H20N4O4S2/c1-12-11-27-18-19-13(2)16(17(23)22(12)18)28(24,25)20-14-3-5-15(6-4-14)21-7-9-26-10-8-21/h3-6,11,20H,7-10H2,1-2H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM50199883
PNG
(3,4‐Dichloroisocoumarin (2) | 3,4-Dichloro-i...)
Show SMILES Clc1oc(=O)c2ccccc2c1Cl
Show InChI InChI=1S/C9H4Cl2O2/c10-7-5-3-1-2-4-6(5)9(12)13-8(7)11/h1-4H
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM50049391
PNG
(3,5,7-Trihydroxyflavone | 3,5,7-triOH-flavone | 3,...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccccc1)c(O)c2=O
Show InChI InChI=1S/C15H10O5/c16-9-6-10(17)12-11(7-9)20-15(14(19)13(12)18)8-4-2-1-3-5-8/h1-7,16-17,19H
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM46565
PNG
(2-Chloro-1-(5-methyl-1H-indol-3-yl)-ethanone | 2-c...)
Show SMILES Cc1ccc2[nH]cc(C(=O)CCl)c2c1
Show InChI InChI=1S/C11H10ClNO/c1-7-2-3-10-8(4-7)9(6-13-10)11(14)5-12/h2-4,6,13H,5H2,1H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77779
PNG
((E)-3-amino-2-[(2-chlorobenzylidene)amino]-3-metho...)
Show SMILES COC(=N)C(N=Cc1ccccc1Cl)C#N
Show InChI InChI=1S/C11H10ClN3O/c1-16-11(14)10(6-13)15-7-8-4-2-3-5-9(8)12/h2-5,7,10,14H,1H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM58163
PNG
(3-(6-Methyl-benzothiazol-2-yl)-2-thioxo-imidazolid...)
Show SMILES Cc1ccc2nc(sc2c1)-n1c(O)c[nH]c1=S
Show InChI InChI=1S/C11H9N3OS2/c1-6-2-3-7-8(4-6)17-11(13-7)14-9(15)5-12-10(14)16/h2-5,15H,1H3,(H,12,16)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM26682
PNG
(2-amino-6-(4-hydroxyphenyl)-4-phenylpyridine-3-car...)
Show SMILES Nc1nc(cc(-c2ccccc2)c1C#N)-c1ccc(O)cc1
Show InChI InChI=1S/C18H13N3O/c19-11-16-15(12-4-2-1-3-5-12)10-17(21-18(16)20)13-6-8-14(22)9-7-13/h1-10,22H,(H2,20,21)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM66744
PNG
(2-methylene-6-(2-methylpropoxy)-4,9-dihydro-3H-car...)
Show SMILES CC(C)COc1ccc2[nH]c3c(CCC(=C)C3=O)c2c1
Show InChI InChI=1S/C17H19NO2/c1-10(2)9-20-12-5-7-15-14(8-12)13-6-4-11(3)17(19)16(13)18-15/h5,7-8,10,18H,3-4,6,9H2,1-2H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM39541
PNG
(MLS000041618 | N-[2-(5-bromanylfuran-2-yl)-3H-benz...)
Show SMILES Brc1ccc(o1)-c1nc2ccc(NC(=O)c3cccs3)cc2[nH]1
Show InChI InChI=1S/C16H10BrN3O2S/c17-14-6-5-12(22-14)15-19-10-4-3-9(8-11(10)20-15)18-16(21)13-2-1-7-23-13/h1-8H,(H,18,21)(H,19,20)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM61604
PNG
((Z)-2-(1H-Benzoimidazol-2-yl)-3-(5-morpholin-4-yl-...)
Show SMILES N#C\C(=C\c1ccc(o1)N1CCOCC1)c1nc2ccccc2[nH]1
Show InChI InChI=1S/C18H16N4O2/c19-12-13(18-20-15-3-1-2-4-16(15)21-18)11-14-5-6-17(24-14)22-7-9-23-10-8-22/h1-6,11H,7-10H2,(H,20,21)/b13-11-
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77695
PNG
(7-(2-furanylmethyl)-3-(2-methylpropyl)-5,6-dipheny...)
Show SMILES CC(C)Cn1cnc2n(Cc3ccco3)c(c(-c3ccccc3)c2c1=N)-c1ccccc1
Show InChI InChI=1S/C27H26N4O/c1-19(2)16-30-18-29-27-24(26(30)28)23(20-10-5-3-6-11-20)25(21-12-7-4-8-13-21)31(27)17-22-14-9-15-32-22/h3-15,18-19,28H,16-17H2,1-2H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77730
PNG
(4-methyl-N-[(2-methyl-1H-indol-5-yl)methyl]-3-nitr...)
Show SMILES Cc1cc2cc(CNC(=O)c3ccc(C)c(c3)[N+]([O-])=O)ccc2[nH]1
Show InChI InChI=1S/C18H17N3O3/c1-11-3-5-14(9-17(11)21(23)24)18(22)19-10-13-4-6-16-15(8-13)7-12(2)20-16/h3-9,20H,10H2,1-2H3,(H,19,22)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77738
PNG
((E)-3-(3,4-dimethoxyphenyl)-N-indan-5-yl-acrylamid...)
Show SMILES COc1ccc(\C=C\C(=O)Nc2ccc3CCCc3c2)cc1OC
Show InChI InChI=1S/C20H21NO3/c1-23-18-10-6-14(12-19(18)24-2)7-11-20(22)21-17-9-8-15-4-3-5-16(15)13-17/h6-13H,3-5H2,1-2H3,(H,21,22)/b11-7+
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM65290
PNG
(2-(2-furoylimino)-3,4-dimethyl-4-thiazoline-5-carb...)
Show SMILES CCOC(=O)c1s\c(=N/C(=O)c2ccco2)n(C)c1C
Show InChI InChI=1S/C13H14N2O4S/c1-4-18-12(17)10-8(2)15(3)13(20-10)14-11(16)9-6-5-7-19-9/h5-7H,4H2,1-3H3/b14-13-
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77861
PNG
(2-(5-Phenyl-2,3-dihydro-[1,3,4]thiadiazol-2-yl)-ph...)
Show SMILES Oc1ccccc1C1=NNC(S1)c1ccccc1
Show InChI InChI=1S/C14H12N2OS/c17-12-9-5-4-8-11(12)14-16-15-13(18-14)10-6-2-1-3-7-10/h1-9,13,15,17H
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM71500
PNG
(MLS001223930 | N-[(6-chloranyl-4-oxidanylidene-chr...)
Show SMILES COc1ccc(cc1)C(=O)NN=Cc1coc2ccc(Cl)cc2c1=O
Show InChI InChI=1S/C18H13ClN2O4/c1-24-14-5-2-11(3-6-14)18(23)21-20-9-12-10-25-16-7-4-13(19)8-15(16)17(12)22/h2-10H,1H3,(H,21,23)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77926
PNG
(MLS001142155 | N-(6-amino-1-butyl-2,4-diketo-pyrim...)
Show SMILES CCCCn1c(N)c(N(CCC(C)C)C(=O)c2ccc3OCOc3c2)c(=O)[nH]c1=O
Show InChI InChI=1S/C21H28N4O5/c1-4-5-9-25-18(22)17(19(26)23-21(25)28)24(10-8-13(2)3)20(27)14-6-7-15-16(11-14)30-12-29-15/h6-7,11,13H,4-5,8-10,12,22H2,1-3H3,(H,23,26,28)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77648
PNG
(2-[(4-ketopyrido[1,2-a]pyrimidin-2-yl)methylthio]n...)
Show SMILES CCOC(=O)c1cccnc1SCc1cc(=O)n2ccccc2n1
Show InChI InChI=1S/C17H15N3O3S/c1-2-23-17(22)13-6-5-8-18-16(13)24-11-12-10-15(21)20-9-4-3-7-14(20)19-12/h3-10H,2,11H2,1H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77651
PNG
(2-methyl-5-[2,2,2-trifluoro-1,1-bis(trifluoromethy...)
Show SMILES Cc1nc2ccc(cc2[nH]1)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C12H7F9N2/c1-5-22-7-3-2-6(4-8(7)23-5)9(10(13,14)15,11(16,17)18)12(19,20)21/h2-4H,1H3,(H,22,23)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77748
PNG
((4Z)-4-[(E)-3-(2-furanyl)prop-2-enylidene]-2-pheny...)
Show SMILES O=C1OC(=N\C1=C/C=C/c1ccco1)c1ccccc1
Show InChI InChI=1S/C16H11NO3/c18-16-14(10-4-8-13-9-5-11-19-13)17-15(20-16)12-6-2-1-3-7-12/h1-11H/b8-4+,14-10-
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM76576
PNG
(MLS000769933 | N-[[(E)-2-chloranyl-3-phenyl-prop-2...)
Show SMILES Cl\C(C=NNC(=O)c1cccs1)=C\c1ccccc1
Show InChI InChI=1S/C14H11ClN2OS/c15-12(9-11-5-2-1-3-6-11)10-16-17-14(18)13-7-4-8-19-13/h1-10H,(H,17,18)/b12-9+,16-10?
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM58626
PNG
(5-chloro-N-[4-(difluoromethoxy)phenyl]-2-(4-methyl...)
Show SMILES Cc1ccc(CS(=O)(=O)c2ncc(Cl)c(n2)C(=O)Nc2ccc(OC(F)F)cc2)cc1
Show InChI InChI=1S/C20H16ClF2N3O4S/c1-12-2-4-13(5-3-12)11-31(28,29)20-24-10-16(21)17(26-20)18(27)25-14-6-8-15(9-7-14)30-19(22)23/h2-10,19H,11H2,1H3,(H,25,27)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77920
PNG
(4-[[2-[(4-keto-9-methyl-pyrido[1,2-a][1,3,5]triazi...)
Show SMILES CCOC(=O)c1ccc(NC(=O)CSc2nc3c(C)cccn3c(=O)n2)cc1
Show InChI InChI=1S/C19H18N4O4S/c1-3-27-17(25)13-6-8-14(9-7-13)20-15(24)11-28-18-21-16-12(2)5-4-10-23(16)19(26)22-18/h4-10H,3,11H2,1-2H3,(H,20,24)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77727
PNG
((4Z)-4-(4-chlorobenzylidene)-6,7-dimethoxy-isochro...)
Show SMILES COc1cc2COC(=O)\C(=C/c3ccc(Cl)cc3)c2cc1OC
Show InChI InChI=1S/C18H15ClO4/c1-21-16-8-12-10-23-18(20)15(14(12)9-17(16)22-2)7-11-3-5-13(19)6-4-11/h3-9H,10H2,1-2H3/b15-7-
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77811
PNG
(MLS000860470 | N-[4-(2,3-dihydroimidazo[2,1-b][1,3...)
Show SMILES O=C(Nc1ccc(cc1)-c1cn2CCSc2n1)c1ccco1
Show InChI InChI=1S/C16H13N3O2S/c20-15(14-2-1-8-21-14)17-12-5-3-11(4-6-12)13-10-19-7-9-22-16(19)18-13/h1-6,8,10H,7,9H2,(H,17,20)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77905
PNG
(MLS001224374 | N-[(6-chloranyl-4-oxidanylidene-chr...)
Show SMILES Clc1ccc2occ(C=NNC(=O)c3ccncc3)c(=O)c2c1
Show InChI InChI=1S/C16H10ClN3O3/c17-12-1-2-14-13(7-12)15(21)11(9-23-14)8-19-20-16(22)10-3-5-18-6-4-10/h1-9H,(H,20,22)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM38880
PNG
(6-methoxy-2-phenyl-imidazo[2,1-b][1,3]benzothiazol...)
Show SMILES COc1ccc2c(c1)sc1nc(cn21)-c1ccccc1
Show InChI InChI=1S/C16H12N2OS/c1-19-12-7-8-14-15(9-12)20-16-17-13(10-18(14)16)11-5-3-2-4-6-11/h2-10H,1H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM38118
PNG
(2-[(4-ketopyrido[1,2-a]pyrimidin-2-yl)methylthio]n...)
Show SMILES CC(C)OC(=O)c1cccnc1SCc1cc(=O)n2ccccc2n1
Show InChI InChI=1S/C18H17N3O3S/c1-12(2)24-18(23)14-6-5-8-19-17(14)25-11-13-10-16(22)21-9-4-3-7-15(21)20-13/h3-10,12H,11H2,1-2H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM60493
PNG
(2-Chloro-2-(3-oxo-1-phenyl-pentyl)-indan-1,3-dione...)
Show SMILES CCC(=O)CC(c1ccccc1)C1(Cl)C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C20H17ClO3/c1-2-14(22)12-17(13-8-4-3-5-9-13)20(21)18(23)15-10-6-7-11-16(15)19(20)24/h3-11,17H,2,12H2,1H3
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77767
PNG
(MLS000723710 | N'-[(1E,2Z)-3-(2-furyl)prop-2-e...)
Show SMILES O=C(NN=C\C=C/c1ccco1)c1cccs1
Show InChI InChI=1S/C12H10N2O2S/c15-12(11-6-3-9-17-11)14-13-7-1-4-10-5-2-8-16-10/h1-9H,(H,14,15)/b4-1-,13-7?
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77791
PNG
(2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-(2-ph...)
Show SMILES [O-][n+]1ccccc1SCC(=O)Nc1ccccc1Oc1ccccc1
Show InChI InChI=1S/C19H16N2O3S/c22-18(14-25-19-12-6-7-13-21(19)23)20-16-10-4-5-11-17(16)24-15-8-2-1-3-9-15/h1-13H,14H2,(H,20,22)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77909
PNG
(MLS001224629 | N-[(6-chloranyl-4-oxidanylidene-chr...)
Show SMILES Oc1cc(O)cc(c1)C(=O)NN=Cc1coc2ccc(Cl)cc2c1=O
Show InChI InChI=1S/C17H11ClN2O5/c18-11-1-2-15-14(5-11)16(23)10(8-25-15)7-19-20-17(24)9-3-12(21)6-13(22)4-9/h1-8,21-22H,(H,20,24)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM16018
PNG
(14,15-diazatetracyclo[7.6.1.0^{2,7}.0^{13,16}]hexa...)
Show SMILES O=C1c2ccccc2-c2n[nH]c3cccc1c23
Show InChI InChI=1S/C14H8N2O/c17-14-9-5-2-1-4-8(9)13-12-10(14)6-3-7-11(12)15-16-13/h1-7H,(H,15,16)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77935
PNG
(MLS002165238 | N-(6-amino-1-benzyl-2,4-diketo-pyri...)
Show SMILES CCCN(C(=O)c1ccc(c(C)c1)[N+]([O-])=O)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O
Show InChI InChI=1S/C22H23N5O5/c1-3-11-25(21(29)16-9-10-17(27(31)32)14(2)12-16)18-19(23)26(22(30)24-20(18)28)13-15-7-5-4-6-8-15/h4-10,12H,3,11,13,23H2,1-2H3,(H,24,28,30)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77672
PNG
(MLS000102881 | N-(4-tert-butyl-1,3-thiazol-2-yl)-5...)
Show SMILES CC(C)(C)c1csc(NC(=O)c2ccc(Cl)s2)n1
Show InChI InChI=1S/C12H13ClN2OS2/c1-12(2,3)8-6-17-11(14-8)15-10(16)7-4-5-9(13)18-7/h4-6H,1-3H3,(H,14,15,16)
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77736
PNG
(1H-benzimidazol-2-yl-[[(E)-3-phenylprop-2-enyliden...)
Show SMILES C(C=CN=Nc1nc2ccccc2[nH]1)c1ccccc1
Show InChI InChI=1S/C16H14N4/c1-2-7-13(8-3-1)9-6-12-17-20-16-18-14-10-4-5-11-15(14)19-16/h1-8,10-12H,9H2,(H,18,19)/b12-6+,20-17+
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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)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%