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Compile Data Set for Download or QSAR

Found 2368 hits Enz. Inhib. hit(s) with all data for entry = 4331   
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
Heat shock factor protein 1


(Mus musculus)		BDBM63359
PNG
(4-(3,4-dimethylphenyl)-10-(1-methylethylidene)-4-a...)
Show SMILES [H]C12[#6]-[#6]C([H])([#6]-3-[#6]1-[#6](=O)-[#7](-[#6]-3=O)-c1ccc(-[#6])c(-[#6])c1)\[#6]2=[#6](/[#6])-[#6] |TLB:8:7:21:3.2,THB:11:6:21:3.2|
Show InChI InChI=1S/C20H23NO2/c1-10(2)16-14-7-8-15(16)18-17(14)19(22)21(20(18)23)13-6-5-11(3)12(4)9-13/h5-6,9,14-15,17-18H,7-8H2,1-4H3
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n/an/an/an/a>1.95E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63360
PNG
(2-[[(E)-3-(2,4-dichlorophenyl)-1-oxoprop-2-enyl]am...)
Show SMILES CN(C)C(=O)c1sc(NC(=O)\C=C\c2ccc(Cl)cc2Cl)nc1C
Show InChI InChI=1S/C16H15Cl2N3O2S/c1-9-14(15(23)21(2)3)24-16(19-9)20-13(22)7-5-10-4-6-11(17)8-12(10)18/h4-8H,1-3H3,(H,19,20,22)/b7-5+
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63361
PNG
(3-[2-(3-methylphenoxy)ethanoylamino]-N-(2-methylpr...)
Show SMILES CC(C)CNC(=O)c1cccc(NC(=O)COc2cccc(C)c2)c1
Show InChI InChI=1S/C20H24N2O3/c1-14(2)12-21-20(24)16-7-5-8-17(11-16)22-19(23)13-25-18-9-4-6-15(3)10-18/h4-11,14H,12-13H2,1-3H3,(H,21,24)(H,22,23)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63362
PNG
((4-amino-5-methyl-1,2,4-triazol-3-yl)-[[1-(4-fluor...)
Show SMILES Cc1cc(CN=Nc2nnc(C)n2N)c(C)n1-c1ccc(F)cc1 |w:5.4|
Show InChI InChI=1S/C16H18FN7/c1-10-8-13(9-19-21-16-22-20-12(3)24(16)18)11(2)23(10)15-6-4-14(17)5-7-15/h4-8H,9,18H2,1-3H3
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n/an/an/an/a 2.97E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63363
PNG
(2-methyl-N,3-diphenyl-propanamide | 2-methyl-N,3-d...)
Show SMILES CC(Cc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C16H17NO/c1-13(12-14-8-4-2-5-9-14)16(18)17-15-10-6-3-7-11-15/h2-11,13H,12H2,1H3,(H,17,18)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63364
PNG
(MLS000563777 | N-[(R)-[(1R,2R)-2-butylcyclopropyl]...)
Show SMILES CCCC[C@@H]1C[C@H]1[C@@H](NC(=O)c1ccco1)c1ccc(Cl)cc1
Show InChI InChI=1S/C19H22ClNO2/c1-2-3-5-14-12-16(14)18(13-7-9-15(20)10-8-13)21-19(22)17-6-4-11-23-17/h4,6-11,14,16,18H,2-3,5,12H2,1H3,(H,21,22)/t14-,16-,18+/m1/s1
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Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63365
PNG
(MLS000563709 | SMR000388881 | [2-[[2-(1H-indol-3-y...)
Show SMILES CC(=O)OCC(=O)NCC(=O)c1c[nH]c2ccccc12
Show InChI InChI=1S/C14H14N2O4/c1-9(17)20-8-14(19)16-7-13(18)11-6-15-12-5-3-2-4-10(11)12/h2-6,15H,7-8H2,1H3,(H,16,19)
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Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63366
PNG
(MLS000563668 | SMR000388868 | cid_5459639)
Show SMILES CCCCNC(=O)C(N(CCc1c[nH]c2ccccc12)C(=O)CCCCCN1C(=O)NC(C(C(=O)OCc2ccccc2)=C1C)c1ccc(cc1)-c1ccccc1)c1ccc(OCC(=O)OC)c(c1)C(=O)OC |c:45|
Show InChI InChI=1S/C58H63N5O10/c1-5-6-32-59-55(66)54(44-29-30-49(72-38-51(65)70-3)47(35-44)56(67)71-4)63(34-31-45-36-60-48-23-16-15-22-46(45)48)50(64)24-14-9-17-33-62-39(2)52(57(68)73-37-40-18-10-7-11-19-40)53(61-58(62)69)43-27-25-42(26-28-43)41-20-12-8-13-21-41/h7-8,10-13,15-16,18-23,25-30,35-36,53-54,60H,5-6,9,14,17,24,31-34,37-38H2,1-4H3,(H,59,66)(H,61,69)
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Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63367
PNG
(4-[3-[1-[(1S)-1-tert-butoxycarbonyl-3-methyl-butyl...)
Show SMILES COC(=O)[C@H](CO)n1cc(nn1)-c1cc(cc(c1)-c1cn(nn1)[C@@H](CC(C)C)C(=O)OC(C)(C)C)C(=O)N1CCN(CC1)C(=O)OC(C)(C)C
Show InChI InChI=1S/C34H48N8O8/c1-21(2)14-27(31(46)49-33(3,4)5)41-18-25(35-37-41)22-15-23(26-19-42(38-36-26)28(20-43)30(45)48-9)17-24(16-22)29(44)39-10-12-40(13-11-39)32(47)50-34(6,7)8/h15-19,21,27-28,43H,10-14,20H2,1-9H3/t27-,28-/m0/s1
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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63368
PNG
(7-(2-morpholin-4-ylethylamino)isoquinoline-5,8-dio...)
Show SMILES Oc1cc(N=CCN2CCOCC2)c(O)c2cnccc12 |w:4.3|
Show InChI InChI=1S/C15H17N3O3/c19-14-9-13(15(20)12-10-16-2-1-11(12)14)17-3-4-18-5-7-21-8-6-18/h1-3,9-10,19-20H,4-8H2
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n/an/an/an/a 1.04E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM51824
PNG
((2S)-6-amino-2-[4-[3-[1-[(1S)-1-(1H-indol-3-ylmeth...)
Show SMILES COC(=O)[C@H](CCCCN)n1cc(nn1)-c1cc(cc(c1)-c1cn(nn1)[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC)C(=O)N1CCNCC1
Show InChI InChI=1S/C34H40N10O5/c1-48-33(46)30(9-5-6-10-35)43-20-28(38-40-43)22-15-23(17-24(16-22)32(45)42-13-11-36-12-14-42)29-21-44(41-39-29)31(34(47)49-2)18-25-19-37-27-8-4-3-7-26(25)27/h3-4,7-8,15-17,19-21,30-31,36-37H,5-6,9-14,18,35H2,1-2H3/t30-,31-/m0/s1
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63369
PNG
((2S)-6-amino-2-[4-[(1R)-1-amino-2-hydroxy-ethyl]tr...)
Show SMILES NCCCC[C@@H](C(=O)N1CCNCC1)n1cc(nn1)[C@@H](N)CO
Show InChI InChI=1S/C14H27N7O2/c15-4-2-1-3-13(14(23)20-7-5-17-6-8-20)21-9-12(18-19-21)11(16)10-22/h9,11,13,17,22H,1-8,10,15-16H2/t11-,13-/m0/s1
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Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63371
PNG
(MLS000540482 | SMR000125740 | cid_2767560 | ethyl ...)
Show SMILES [H]C12CC([H])(C3C1ON=C3C(=O)OCC)C1C2C(=O)N(CCc2ccc(OC)c(OC)c2)C1=O |c:9,TLB:7:6:15.16:2,17:16:2:5.6,THB:32:15:2:5.6,9:5:15.16:2|
Show InChI InChI=1S/C23H26N2O7/c1-4-31-23(28)19-18-12-10-13(20(18)32-24-19)17-16(12)21(26)25(22(17)27)8-7-11-5-6-14(29-2)15(9-11)30-3/h5-6,9,12-13,16-18,20H,4,7-8,10H2,1-3H3
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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63372
PNG
(2-[3-(4-Chloro-phenyl)-5-oxo-[1,2,4]oxadiazol-4-yl...)
Show SMILES CCOc1ccccc1NC(=O)Cn1c(noc1=O)-c1ccc(Cl)cc1
Show InChI InChI=1S/C18H16ClN3O4/c1-2-25-15-6-4-3-5-14(15)20-16(23)11-22-17(21-26-18(22)24)12-7-9-13(19)10-8-12/h3-10H,2,11H2,1H3,(H,20,23)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63373
PNG
(6-[1-(3-chlorophenyl)-1H-pyrazol-5-yl]-2-(3-methox...)
Show SMILES COc1cccc(c1)-n1nc(-c2ccnn2-c2cccc(Cl)c2)c(=O)n(C)c1=O
Show InChI InChI=1S/C20H16ClN5O3/c1-24-19(27)18(17-9-10-22-25(17)14-6-3-5-13(21)11-14)23-26(20(24)28)15-7-4-8-16(12-15)29-2/h3-12H,1-2H3
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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63374
PNG
(MLS000123651 | N-(4-Cyclopropylsulfamoyl-phenyl)-2...)
Show SMILES CC1CCN(CC(=O)Nc2ccc(cc2)S(=O)(=O)NC2CC2)CC1
Show InChI InChI=1S/C17H25N3O3S/c1-13-8-10-20(11-9-13)12-17(21)18-14-4-6-16(7-5-14)24(22,23)19-15-2-3-15/h4-7,13,15,19H,2-3,8-12H2,1H3,(H,18,21)
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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63375
PNG
(2-(1,2-dimethyl-3-indolyl)-2-oxo-N-(thiophen-2-ylm...)
Show SMILES Cc1c(C(=O)C(=O)NCc2cccs2)c2ccccc2n1C
Show InChI InChI=1S/C17H16N2O2S/c1-11-15(13-7-3-4-8-14(13)19(11)2)16(20)17(21)18-10-12-6-5-9-22-12/h3-9H,10H2,1-2H3,(H,18,21)
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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63377
PNG
(2-[6-(furan-2-yl)pyridazin-3-yl]sulfanyl-N-[2-(4-m...)
Show SMILES COc1ccc(CCNC(=O)CSc2ccc(nn2)-c2ccco2)cc1
Show InChI InChI=1S/C19H19N3O3S/c1-24-15-6-4-14(5-7-15)10-11-20-18(23)13-26-19-9-8-16(21-22-19)17-3-2-12-25-17/h2-9,12H,10-11,13H2,1H3,(H,20,23)
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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63378
PNG
(MLS000678488 | N-cyclohexyl-2-(6-pyridin-2-ylpyrid...)
Show SMILES O=C(CSc1ccc(nn1)-c1ccccn1)NC1CCCCC1
Show InChI InChI=1S/C17H20N4OS/c22-16(19-13-6-2-1-3-7-13)12-23-17-10-9-15(20-21-17)14-8-4-5-11-18-14/h4-5,8-11,13H,1-3,6-7,12H2,(H,19,22)
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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63379
PNG
((4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)...)
Show SMILES OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N1CCN(Cc2ccc3OCOc3c2)CC1)c1ccc(cc1)C(F)(F)F |c:9|
Show InChI InChI=1S/C29H33F3N2O6/c30-29(31,32)23-6-4-21(5-7-23)22-16-26(40-27(17-22)37-14-2-1-13-35)28(36)34-11-9-33(10-12-34)18-20-3-8-24-25(15-20)39-19-38-24/h3-8,15-16,22,27,35H,1-2,9-14,17-19H2/t22-,27+/m0/s1
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63380
PNG
((4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)...)
Show SMILES OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N1CCN(Cc2ccc3OCOc3c2)CC1)c1ccc(Br)cc1 |c:9|
Show InChI InChI=1S/C28H33BrN2O6/c29-23-6-4-21(5-7-23)22-16-26(37-27(17-22)34-14-2-1-13-32)28(33)31-11-9-30(10-12-31)18-20-3-8-24-25(15-20)36-19-35-24/h3-8,15-16,22,27,32H,1-2,9-14,17-19H2/t22-,27+/m0/s1
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63381
PNG
((5Z)-3-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-5-...)
Show SMILES CN(C)c1ccc(\C=C2/SC(=O)N(CCc3nnc(N)s3)C2=O)cc1
Show InChI InChI=1S/C16H17N5O2S2/c1-20(2)11-5-3-10(4-6-11)9-12-14(22)21(16(23)24-12)8-7-13-18-19-15(17)25-13/h3-6,9H,7-8H2,1-2H3,(H2,17,19)/b12-9-
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63382
PNG
(MLS000587659 | N-[5-[2-[2-(2-furanylmethylidene)hy...)
Show SMILES Cc1ccccc1C(=O)Nc1nnc(CC(=O)NN=Cc2ccco2)s1
Show InChI InChI=1S/C17H15N5O3S/c1-11-5-2-3-7-13(11)16(24)19-17-22-21-15(26-17)9-14(23)20-18-10-12-6-4-8-25-12/h2-8,10H,9H2,1H3,(H,20,23)(H,19,22,24)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63384
PNG
(1-(2-cyanoethyl)-N-(4-nitrophenyl)-3-phenyl-4-pyra...)
Show SMILES [O-][N+](=O)c1ccc(NC(=O)c2cn(CCC#N)nc2-c2ccccc2)cc1
Show InChI InChI=1S/C19H15N5O3/c20-11-4-12-23-13-17(18(22-23)14-5-2-1-3-6-14)19(25)21-15-7-9-16(10-8-15)24(26)27/h1-3,5-10,13H,4,12H2,(H,21,25)
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Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63385
PNG
((E)-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-cy...)
Show SMILES COc1ccc(\C=C(/C#N)C(=O)Nc2cc(C)c(Cl)cc2OC)cc1O
Show InChI InChI=1S/C19H17ClN2O4/c1-11-6-15(18(26-3)9-14(11)20)22-19(24)13(10-21)7-12-4-5-17(25-2)16(23)8-12/h4-9,23H,1-3H3,(H,22,24)/b13-7+
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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63386
PNG
(2-[4-Methoxy-3-(4-nitro-pyrazol-1-ylmethyl)-phenyl...)
Show SMILES COc1ccc(cc1)N1C(Nc2ccccc2C1=O)c1ccc(OC)c(Cn2cc(cn2)[N+]([O-])=O)c1
Show InChI InChI=1S/C26H23N5O5/c1-35-21-10-8-19(9-11-21)30-25(28-23-6-4-3-5-22(23)26(30)32)17-7-12-24(36-2)18(13-17)15-29-16-20(14-27-29)31(33)34/h3-14,16,25,28H,15H2,1-2H3
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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM61816
PNG
(2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-...)
Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)Nc3nnc(s3)C3CC3)c2c1
Show InChI InChI=1S/C24H21ClN4O3S/c1-13-18(12-21(30)26-24-28-27-22(33-24)14-3-4-14)19-11-17(32-2)9-10-20(19)29(13)23(31)15-5-7-16(25)8-6-15/h5-11,14H,3-4,12H2,1-2H3,(H,26,28,30)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63387
PNG
(2-chloranyl-6-methoxy-quinoline-3-carbonitrile | 2...)
Show SMILES COc1ccc2nc(Cl)c(cc2c1)C#N
Show InChI InChI=1S/C11H7ClN2O/c1-15-9-2-3-10-7(5-9)4-8(6-13)11(12)14-10/h2-5H,1H3
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Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63389
PNG
(1-({5-[(2-chloro-4-fluorophenoxy)methyl]isoxazol-3...)
Show SMILES Cn1ccnc1C1CCCCN1C(=O)c1cc(COc2ccc(F)cc2Cl)on1
Show InChI InChI=1S/C20H20ClFN4O3/c1-25-9-7-23-19(25)17-4-2-3-8-26(17)20(27)16-11-14(29-24-16)12-28-18-6-5-13(22)10-15(18)21/h5-7,9-11,17H,2-4,8,12H2,1H3
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Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63390
PNG
(2-[4-cyclopentyl-1-(1-isopropyl-4-piperidyl)pipera...)
Show SMILES CC(C)N1CCC(CC1)N1CCN(CC1CCO)C1CCCC1
Show InChI InChI=1S/C19H37N3O/c1-16(2)20-10-7-18(8-11-20)22-13-12-21(15-19(22)9-14-23)17-5-3-4-6-17/h16-19,23H,3-15H2,1-2H3
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Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63391
PNG
(2-(4-ethoxyanilino)-1-(4-methylphenyl)ethanone | 2...)
Show SMILES CCOc1ccc(NCC(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C17H19NO2/c1-3-20-16-10-8-15(9-11-16)18-12-17(19)14-6-4-13(2)5-7-14/h4-11,18H,3,12H2,1-2H3
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63392
PNG
(1-benzyl-3-[3-(dimethylamino)propyl]-1-[(2-keto-8-...)
Show SMILES CN(C)CCCNC(=S)N(Cc1ccccc1)Cc1cc2cccc(C)c2[nH]c1=O
Show InChI InChI=1S/C24H30N4OS/c1-18-9-7-12-20-15-21(23(29)26-22(18)20)17-28(16-19-10-5-4-6-11-19)24(30)25-13-8-14-27(2)3/h4-7,9-12,15H,8,13-14,16-17H2,1-3H3,(H,25,30)(H,26,29)
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Broad Institute

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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63393
PNG
(2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[3-[(2-fluo...)
Show SMILES Cn1c2ncn(CC(=O)Nc3cccc(c3)S(=O)(=O)Nc3ccccc3F)c2c(=O)n(C)c1=O
Show InChI InChI=1S/C21H19FN6O5S/c1-26-19-18(20(30)27(2)21(26)31)28(12-23-19)11-17(29)24-13-6-5-7-14(10-13)34(32,33)25-16-9-4-3-8-15(16)22/h3-10,12,25H,11H2,1-2H3,(H,24,29)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM55675
PNG
((E)-N-[2-(cyclohexylamino)-2-keto-ethyl]-N-(4-fluo...)
Show SMILES COc1ccc(C(=O)\C=C\C(=O)N(CC(=O)NC2CCCCC2)Cc2ccc(F)cc2)c(O)c1
Show InChI InChI=1S/C26H29FN2O5/c1-34-21-11-12-22(24(31)15-21)23(30)13-14-26(33)29(16-18-7-9-19(27)10-8-18)17-25(32)28-20-5-3-2-4-6-20/h7-15,20,31H,2-6,16-17H2,1H3,(H,28,32)/b14-13+
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63396
PNG
(MLS000700011 | N-[2-(1,2,3-thiadiazol-4-ylcarbonyl...)
Show SMILES O=C(Nc1ccccc1NC(=O)c1csnn1)c1csnn1
Show InChI InChI=1S/C12H8N6O2S2/c19-11(9-5-21-17-15-9)13-7-3-1-2-4-8(7)14-12(20)10-6-22-18-16-10/h1-6H,(H,13,19)(H,14,20)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63397
PNG
(MLS000723546 | SMR000305141 | cid_5833488 | ethyl ...)
Show SMILES CCOC(=O)N\N=C1\c2ccccc2-c2nc3nonc3nc12
Show InChI InChI=1S/C14H10N6O3/c1-2-22-14(21)18-17-10-8-6-4-3-5-7(8)9-11(10)16-13-12(15-9)19-23-20-13/h3-6H,2H2,1H3,(H,18,21)/b17-10-
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63398
PNG
(2-methyl-4-[4-(4-morpholinylmethyl)-2-thiophenyl]-...)
Show SMILES CC1=C(C(C2C(=O)CCCC2=N1)c1cc(CN2CCOCC2)cs1)C(=O)Nc1ccccc1 |c:11,t:1|
Show InChI InChI=1S/C26H29N3O3S/c1-17-23(26(31)28-19-6-3-2-4-7-19)25(24-20(27-17)8-5-9-21(24)30)22-14-18(16-33-22)15-29-10-12-32-13-11-29/h2-4,6-7,14,16,24-25H,5,8-13,15H2,1H3,(H,28,31)
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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63399
PNG
(3-(3-chlorobenzoyl)-N-propyl-piperidine-1-carboxam...)
Show SMILES CCCNC(=O)N1CCCC(C1)C(=O)c1cccc(Cl)c1
Show InChI InChI=1S/C16H21ClN2O2/c1-2-8-18-16(21)19-9-4-6-13(11-19)15(20)12-5-3-7-14(17)10-12/h3,5,7,10,13H,2,4,6,8-9,11H2,1H3,(H,18,21)
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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63402
PNG
(MLS000729334 | N-(1,3-benzodioxol-5-yl)-2-[1-(3-hy...)
Show SMILES OCCCn1nnnc1SCC(=O)Nc1ccc2OCOc2c1
Show InChI InChI=1S/C13H15N5O4S/c19-5-1-4-18-13(15-16-17-18)23-7-12(20)14-9-2-3-10-11(6-9)22-8-21-10/h2-3,6,19H,1,4-5,7-8H2,(H,14,20)
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Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63403
PNG
(3-[(3,5-dichloro-2-pyridinyl)hydrazo]-1-(4-methoxy...)
Show SMILES COc1ccc(cc1)-n1c(O)cc(NNc2ncc(Cl)cc2Cl)c1O
Show InChI InChI=1S/C16H14Cl2N4O3/c1-25-11-4-2-10(3-5-11)22-14(23)7-13(16(22)24)20-21-15-12(18)6-9(17)8-19-15/h2-8,20,23-24H,1H3,(H,19,21)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63405
PNG
(2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-methyl-q...)
Show SMILES C[n+]1c(\C=C\c2ccc3OCOc3c2)ccc2ccccc12
Show InChI InChI=1S/C19H16NO2/c1-20-16(10-8-15-4-2-3-5-17(15)20)9-6-14-7-11-18-19(12-14)22-13-21-18/h2-12H,13H2,1H3/q+1/b9-6+
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n/an/an/an/a 181n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM46940
PNG
(MLS000723969 | N-(2-bromanyl-4-methyl-phenyl)-1-(4...)
Show SMILES Cc1ccc(NC(=O)c2cnc(N3CCN(CC3)c3ccccn3)c3ccccc23)c(Br)c1
Show InChI InChI=1S/C26H24BrN5O/c1-18-9-10-23(22(27)16-18)30-26(33)21-17-29-25(20-7-3-2-6-19(20)21)32-14-12-31(13-15-32)24-8-4-5-11-28-24/h2-11,16-17H,12-15H2,1H3,(H,30,33)
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n/an/an/an/a 8.67E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63406
PNG
(MLS000624958 | N-[4-(diethylamino)benzyl]-1-[2-(4-...)
Show SMILES CCN(CC)c1ccc(CNc2nc3ccccc3n2CCN2CCOCC2)cc1
Show InChI InChI=1S/C24H33N5O/c1-3-28(4-2)21-11-9-20(10-12-21)19-25-24-26-22-7-5-6-8-23(22)29(24)14-13-27-15-17-30-18-16-27/h5-12H,3-4,13-19H2,1-2H3,(H,25,26)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63407
PNG
(MLS000621650 | N-[2-(4-methoxyphenyl)ethyl]-4-[met...)
Show SMILES COc1ccc(CCNC(=O)c2ccc(cc2)N(C)S(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C24H26N2O4S/c1-18-4-14-23(15-5-18)31(28,29)26(2)21-10-8-20(9-11-21)24(27)25-17-16-19-6-12-22(30-3)13-7-19/h4-15H,16-17H2,1-3H3,(H,25,27)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63410
PNG
(1-[2-(benzotriazol-1-yl)ethanoylamino]-3-cyclohexy...)
Show SMILES O=C(Cn1nnc2ccccc12)NNC(=S)NC1CCCCC1
Show InChI InChI=1S/C15H20N6OS/c22-14(10-21-13-9-5-4-8-12(13)17-20-21)18-19-15(23)16-11-6-2-1-3-7-11/h4-5,8-9,11H,1-3,6-7,10H2,(H,18,22)(H2,16,19,23)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63411
PNG
(MLS000723409 | N-(2-{(2Z)-2-[1-(4-nitrophenyl)ethy...)
Show SMILES C[C+]([N-]NC(=O)CNC(=O)c1ccccn1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N5O4/c1-11(12-5-7-13(8-6-12)21(24)25)19-20-15(22)10-18-16(23)14-4-2-3-9-17-14/h2-9H,10H2,1H3,(H2-,17,18,19,20,22,23)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM43726
PNG
(MLS000662583 | N-[(4-fluoroanilino)-sulfanylidenem...)
Show SMILES Fc1ccc(NC(=S)NC(=O)c2ccc3OCCOc3c2)cc1
Show InChI InChI=1S/C16H13FN2O3S/c17-11-2-4-12(5-3-11)18-16(23)19-15(20)10-1-6-13-14(9-10)22-8-7-21-13/h1-6,9H,7-8H2,(H2,18,19,20,23)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63413
PNG
((4Z)-4-[(5-methyl-1-phenyl-pyrazol-4-yl)-oxidanyl-...)
Show SMILES Cc1c(cnn1-c1ccccc1)C(=O)C1C(N(CCN2CCOCC2)C(=O)C1=O)c1ccccn1
Show InChI InChI=1S/C26H27N5O4/c1-18-20(17-28-31(18)19-7-3-2-4-8-19)24(32)22-23(21-9-5-6-10-27-21)30(26(34)25(22)33)12-11-29-13-15-35-16-14-29/h2-10,17,22-23H,11-16H2,1H3
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63414
PNG
((4-acetamidophenyl) 2-methylbenzenesulfonate | 2-m...)
Show SMILES CC(=O)Nc1ccc(OS(=O)(=O)c2ccccc2C)cc1
Show InChI InChI=1S/C15H15NO4S/c1-11-5-3-4-6-15(11)21(18,19)20-14-9-7-13(8-10-14)16-12(2)17/h3-10H,1-2H3,(H,16,17)
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
Heat shock factor protein 1


(Mus musculus)		BDBM63415
PNG
(MLS000733374 | N-[[3-(2-chlorophenyl)-1-(4-fluorop...)
Show SMILES Fc1ccc(cc1)-n1cc(CNCCc2ccccn2)c(n1)-c1ccccc1Cl
Show InChI InChI=1S/C23H20ClFN4/c24-22-7-2-1-6-21(22)23-17(15-26-14-12-19-5-3-4-13-27-19)16-29(28-23)20-10-8-18(25)9-11-20/h1-11,13,16,26H,12,14-15H2
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Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MW2FKX
More data for this
Ligand-Target Pair
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