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PubChem AID 504672

Compile data set for download or QSAR
Found 42 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)
BDBM71650
PNG
(2,5-Dibutyl-benzene-1,3-diol | 2,5-dibutylbenzene-...)
Show SMILES CCCCc1cc(O)c(CCCC)c(O)c1
Show InChI InChI=1S/C14H22O2/c1-3-5-7-11-9-13(15)12(8-6-4-2)14(16)10-11/h9-10,15-16H,3-8H2,1-2H3
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n/an/a 1.21E+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)


BindingDB Entry DOI: 10.7270/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM67740
PNG
((4-fluorophenyl)-(6,6,8-trimethyl-[1,3]dioxolo[4,5...)
Show SMILES CC1=CC(C)(C)N(C(=O)c2ccc(F)cc2)c2cc3OCOc3cc12
Show InChI InChI=1S/C20H18FNO3/c1-12-10-20(2,3)22(19(23)13-4-6-14(21)7-5-13)16-9-18-17(8-15(12)16)24-11-25-18/h4-10H,11H2,1-3H3
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n/an/a 3.84E+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)


BindingDB Entry DOI: 10.7270/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM76263
PNG
(1-methyl-2-oxidanyl-4-oxidanylidene-N-pyrimidin-2-...)
Show SMILES Cn1c2ccccc2c(O)c(C(=O)Nc2ncccn2)c1=O
Show InChI InChI=1S/C15H12N4O3/c1-19-10-6-3-2-5-9(10)12(20)11(14(19)22)13(21)18-15-16-7-4-8-17-15/h2-8,20H,1H3,(H,16,17,18,21)
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n/an/a 4.78E+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)


BindingDB Entry DOI: 10.7270/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM47396
PNG
((5-hydroxynaphthalen-1-yl) benzoate | (5-oxidanyln...)
Show SMILES Oc1cccc2c(OC(=O)c3ccccc3)cccc12
Show InChI InChI=1S/C17H12O3/c18-15-10-4-9-14-13(15)8-5-11-16(14)20-17(19)12-6-2-1-3-7-12/h1-11,18H
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n/an/a 4.84E+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)


BindingDB Entry DOI: 10.7270/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM49326
PNG
(4-(diethylamino)-N-(3-fluorophenyl)benzamide | MLS...)
Show SMILES CCN(CC)c1ccc(cc1)C(=O)Nc1cccc(F)c1
Show InChI InChI=1S/C17H19FN2O/c1-3-20(4-2)16-10-8-13(9-11-16)17(21)19-15-7-5-6-14(18)12-15/h5-12H,3-4H2,1-2H3,(H,19,21)
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n/an/a 5.64E+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)


BindingDB Entry DOI: 10.7270/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77652
PNG
(2-(4-thiophen-2-yl-1,3-thiazol-2-yl)isoindole-1,3-...)
Show SMILES O=C1N(C(=O)c2ccccc12)c1nc(cs1)-c1cccs1
Show InChI InChI=1S/C15H8N2O2S2/c18-13-9-4-1-2-5-10(9)14(19)17(13)15-16-11(8-21-15)12-6-3-7-20-12/h1-8H
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n/an/a 6.52E+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)


BindingDB Entry DOI: 10.7270/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77646
PNG
(MLS000085596 | N-(5-phenyl-1,2,4-thiadiazol-3-yl)-...)
Show SMILES O=C(Nc1nsc(n1)-c1ccccc1)c1cccs1
Show InChI InChI=1S/C13H9N3OS2/c17-11(10-7-4-8-18-10)14-13-15-12(19-16-13)9-5-2-1-3-6-9/h1-8H,(H,14,16,17)
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n/an/a 6.65E+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)


BindingDB Entry DOI: 10.7270/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77636
PNG
(MLS000041617 | N-[2-(5-bromanylfuran-2-yl)-3H-benz...)
Show SMILES Brc1ccc(o1)-c1nc2ccc(NC(=O)c3ccco3)cc2[nH]1
Show InChI InChI=1S/C16H10BrN3O3/c17-14-6-5-12(23-14)15-19-10-4-3-9(8-11(10)20-15)18-16(21)13-2-1-7-22-13/h1-8H,(H,18,21)(H,19,20)
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n/an/a 6.75E+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)


BindingDB Entry DOI: 10.7270/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM49187
PNG
(4-Methyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid...)
Show SMILES Cn1c(cc2sccc12)C(=O)Nc1ccc2OCCOc2c1
Show InChI InChI=1S/C16H14N2O3S/c1-18-11-4-7-22-15(11)9-12(18)16(19)17-10-2-3-13-14(8-10)21-6-5-20-13/h2-4,7-9H,5-6H2,1H3,(H,17,19)
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n/an/a 7.59E+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)


BindingDB Entry DOI: 10.7270/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM64839
PNG
(2-(3,5-dimethyl-1-pyrazolyl)-4-(2-phenylethylamino...)
Show SMILES CCOC(=O)c1cnc(nc1NCCc1ccccc1)-n1nc(C)cc1C
Show InChI InChI=1S/C20H23N5O2/c1-4-27-19(26)17-13-22-20(25-15(3)12-14(2)24-25)23-18(17)21-11-10-16-8-6-5-7-9-16/h5-9,12-13H,4,10-11H2,1-3H3,(H,21,22,23)
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n/an/a 8.35E+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)


BindingDB Entry DOI: 10.7270/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM40585
PNG
(MLS000038587 | SMR000038600 | cid_657644)
Show SMILES NC(=O)C(C#N)=c1ccc2=NC34CCCCC3CC3=C(CCCC3)N4c2c1
Show InChI InChI=1S/C22H24N4O/c23-13-17(21(24)27)14-8-9-18-20(12-14)26-19-7-2-1-5-15(19)11-16-6-3-4-10-22(16,26)25-18/h8-9,12,16H,1-7,10-11H2,(H2,24,27)
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n/an/a 8.55E+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)


BindingDB Entry DOI: 10.7270/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM37183
PNG
(3-(4-hydroxyphenyl)-5-oxidanyl-7-propan-2-yloxy-ch...)
Show SMILES CC(C)Oc1cc(O)c2c(c1)occ(-c1ccc(O)cc1)c2=O
Show InChI InChI=1S/C18H16O5/c1-10(2)23-13-7-15(20)17-16(8-13)22-9-14(18(17)21)11-3-5-12(19)6-4-11/h3-10,19-20H,1-2H3
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n/an/a 1.01E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM36980
PNG
(3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl...)
Show SMILES Cc1oc2cc(O)cc(O)c2c(=O)c1-c1ccc2OCCCOc2c1
Show InChI InChI=1S/C19H16O6/c1-10-17(11-3-4-14-15(7-11)24-6-2-5-23-14)19(22)18-13(21)8-12(20)9-16(18)25-10/h3-4,7-9,20-21H,2,5-6H2,1H3
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n/an/a 1.07E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77631
PNG
(MLS000029810 | N-(2-Phenyl-benzooxazol-5-yl)-nicot...)
Show SMILES O=C(Nc1ccc2oc(nc2c1)-c1ccccc1)c1cccnc1
Show InChI InChI=1S/C19H13N3O2/c23-18(14-7-4-10-20-12-14)21-15-8-9-17-16(11-15)22-19(24-17)13-5-2-1-3-6-13/h1-12H,(H,21,23)
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n/an/a 1.08E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM74616
PNG
((3-anilino-5-methyl-1-pyrazolyl)-phenylmethanone |...)
Show SMILES Cc1cc(Nc2ccccc2)nn1C(=O)c1ccccc1
Show InChI InChI=1S/C17H15N3O/c1-13-12-16(18-15-10-6-3-7-11-15)19-20(13)17(21)14-8-4-2-5-9-14/h2-12H,1H3,(H,18,19)
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n/an/a 1.13E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77650
PNG
(2-(2-bromanyl-4-tert-butyl-phenoxy)-N-(furan-2-ylm...)
Show SMILES CC(C)(C)c1ccc(OCC(=O)NCc2ccco2)c(Br)c1
Show InChI InChI=1S/C17H20BrNO3/c1-17(2,3)12-6-7-15(14(18)9-12)22-11-16(20)19-10-13-5-4-8-21-13/h4-9H,10-11H2,1-3H3,(H,19,20)
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n/an/a 1.22E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77676
PNG
(3-(2,2-dimethyl-4-oxanyl)-2-(2-hydroxyethylamino)-...)
Show SMILES CC1(C)CC(CCO1)n1c(NCCO)nc2-c3ccccc3CC3(CCCC3)c2c1=O
Show InChI InChI=1S/C25H33N3O3/c1-24(2)16-18(9-14-31-24)28-22(30)20-21(27-23(28)26-12-13-29)19-8-4-3-7-17(19)15-25(20)10-5-6-11-25/h3-4,7-8,18,29H,5-6,9-16H2,1-2H3,(H,26,27)
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n/an/a 1.24E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM43868
PNG
(3-[2-[4-[bis(4-fluorophenyl)methylene]piperidino]e...)
Show SMILES Fc1ccc(cc1)C(=C1CCN(CCn2c(=S)[nH]c3ccccc3c2=O)CC1)c1ccc(F)cc1
Show InChI InChI=1S/C28H25F2N3OS/c29-22-9-5-19(6-10-22)26(20-7-11-23(30)12-8-20)21-13-15-32(16-14-21)17-18-33-27(34)24-3-1-2-4-25(24)31-28(33)35/h1-12H,13-18H2,(H,31,35)
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n/an/a 1.27E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM39524
PNG
((10H-Phenothiazin-2-yl)-carbamic acid ethyl ester ...)
Show SMILES CCOC(=O)Nc1ccc2Sc3ccccc3Nc2c1
Show InChI InChI=1S/C15H14N2O2S/c1-2-19-15(18)16-10-7-8-14-12(9-10)17-11-5-3-4-6-13(11)20-14/h3-9,17H,2H2,1H3,(H,16,18)
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n/an/a 1.27E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77649
PNG
(3-[(2-hydroxy-3-methoxy-benzyl)amino]-2-(m-tolyl)q...)
Show SMILES COc1cccc(CNn2c(nc3ccccc3c2=O)-c2cccc(C)c2)c1O
Show InChI InChI=1S/C23H21N3O3/c1-15-7-5-8-16(13-15)22-25-19-11-4-3-10-18(19)23(28)26(22)24-14-17-9-6-12-20(29-2)21(17)27/h3-13,24,27H,14H2,1-2H3
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n/an/a 1.30E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77655
PNG
(1-(4-methylphenyl)-4-(4-pyridin-2-ylpiperazin-1-yl...)
Show SMILES Cc1ccc(cc1)-c1nnc(N2CCN(CC2)c2ccccn2)c2ccccc12
Show InChI InChI=1S/C24H23N5/c1-18-9-11-19(12-10-18)23-20-6-2-3-7-21(20)24(27-26-23)29-16-14-28(15-17-29)22-8-4-5-13-25-22/h2-13H,14-17H2,1H3
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n/an/a 1.31E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77667
PNG
(5-chloranyl-N-(1,3-thiazol-2-yl)thiophene-2-carbox...)
Show SMILES Clc1ccc(s1)C(=O)Nc1nccs1
Show InChI InChI=1S/C8H5ClN2OS2/c9-6-2-1-5(14-6)7(12)11-8-10-3-4-13-8/h1-4H,(H,10,11,12)
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n/an/a 1.33E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77665
PNG
(1-methyl-N-phenyl-1,3,4,9-tetrahydro-2H-beta-carbo...)
Show SMILES CC1N(CCc2c1[nH]c1ccccc21)C(=O)Nc1ccccc1
Show InChI InChI=1S/C19H19N3O/c1-13-18-16(15-9-5-6-10-17(15)21-18)11-12-22(13)19(23)20-14-7-3-2-4-8-14/h2-10,13,21H,11-12H2,1H3,(H,20,23)
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n/an/a 1.40E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77633
PNG
(5-cycloheptylidene-2-sulfanylidene-1,3-thiazolidin...)
Show SMILES SC1=NC(=O)C(S1)=C1CCCCCC1
Show InChI InChI=1S/C10H13NOS2/c12-9-8(14-10(13)11-9)7-5-3-1-2-4-6-7/h1-6H2,(H,11,12,13)
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n/an/a 1.41E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77669
PNG
(2-methoxy-N-(5-tetralin-6-yl-1,3,4-oxadiazol-2-yl)...)
Show SMILES COc1ccccc1C(=O)Nc1nnc(o1)-c1ccc2CCCCc2c1
Show InChI InChI=1S/C20H19N3O3/c1-25-17-9-5-4-8-16(17)18(24)21-20-23-22-19(26-20)15-11-10-13-6-2-3-7-14(13)12-15/h4-5,8-12H,2-3,6-7H2,1H3,(H,21,23,24)
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n/an/a 1.47E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM49323
PNG
(2-(5-methyl-2-thienyl)-1H-benzimidazole | 2-(5-met...)
Show SMILES Cc1ccc(s1)-c1nc2ccccc2[nH]1
Show InChI InChI=1S/C12H10N2S/c1-8-6-7-11(15-8)12-13-9-4-2-3-5-10(9)14-12/h2-7H,1H3,(H,13,14)
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n/an/a 1.64E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM66037
PNG
((5Z)-5-(1-naphthylmethylene)[1,3]thiazolo[3,2-b][1...)
Show SMILES O=c1n2ncnc2sc1=Cc1cccc2ccccc12
Show InChI InChI=1S/C15H9N3OS/c19-14-13(20-15-16-9-17-18(14)15)8-11-6-3-5-10-4-1-2-7-12(10)11/h1-9H
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n/an/a 1.67E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77627
PNG
(4-Chloro-3-(5-ethyl-benzooxazol-2-yl)-phenylamine ...)
Show SMILES CCc1ccc2oc(nc2c1)-c1cc(N)ccc1Cl
Show InChI InChI=1S/C15H13ClN2O/c1-2-9-3-6-14-13(7-9)18-15(19-14)11-8-10(17)4-5-12(11)16/h3-8H,2,17H2,1H3
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n/an/a 1.70E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM37161
PNG
(4-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2H-...)
Show SMILES Oc1ccc(cc1)-c1cc(no1)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C19H16N2O3/c22-16-7-5-14(6-8-16)18-11-17(20-24-18)19(23)21-10-9-13-3-1-2-4-15(13)12-21/h1-8,11,22H,9-10,12H2
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n/an/a 1.71E+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/Q2959G1S
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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n/an/a 1.99E+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/Q2959G1S
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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n/an/a 2.05E+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/Q2959G1S
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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n/an/a 2.46E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77634
PNG
(5,6,7,8-tetrafluoro-2-methyl-4-oxo-1-benzopyran-3-...)
Show SMILES CCOC(=O)c1c(C)oc2c(F)c(F)c(F)c(F)c2c1=O
Show InChI InChI=1S/C13H8F4O4/c1-3-20-13(19)5-4(2)21-12-6(11(5)18)7(14)8(15)9(16)10(12)17/h3H2,1-2H3
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n/an/a 2.68E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77661
PNG
(MLS000063851 | N-[2-(1-methyl-1H-pyrrol-2-yl)-1H-b...)
Show SMILES Cn1cccc1-c1nc2ccc(NC(=O)c3cccs3)cc2[nH]1
Show InChI InChI=1S/C17H14N4OS/c1-21-8-2-4-14(21)16-19-12-7-6-11(10-13(12)20-16)18-17(22)15-5-3-9-23-15/h2-10H,1H3,(H,18,22)(H,19,20)
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n/an/a 2.82E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77640
PNG
(MLS000060669 | N-(5-phenyl-4-thiophen-2-yl-1,3-thi...)
Show SMILES O=C(Nc1nc(-c2cccs2)c(s1)-c1ccccc1)c1ccco1
Show InChI InChI=1S/C18H12N2O2S2/c21-17(13-8-4-10-22-13)20-18-19-15(14-9-5-11-23-14)16(24-18)12-6-2-1-3-7-12/h1-11H,(H,19,20,21)
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n/an/a 2.86E+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/Q2959G1S
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 3.21E+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/Q2959G1S
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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n/an/a 4.24E+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/Q2959G1S
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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n/an/a 4.93E+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/Q2959G1S
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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n/an/a 5.10E+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/Q2959G1S
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM77629
PNG
(7-Methyl-imidazo[1,2-a]pyridine-2-carboxylic acid ...)
Show SMILES Cc1ccn2cc(nc2c1)C(=O)Nc1ccc2OCCOc2c1
Show InChI InChI=1S/C17H15N3O3/c1-11-4-5-20-10-13(19-16(20)8-11)17(21)18-12-2-3-14-15(9-12)23-7-6-22-14/h2-5,8-10H,6-7H2,1H3,(H,18,21)
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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/Q2959G1S
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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UniChem

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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/Q2959G1S
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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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/Q2959G1S
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%