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PubChem AID 2745

Compile Data Set for Download or QSAR

Found 205 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
LAP4


(Saccharomyces cerevisiae)
BDBM37061
PNG
((4-methoxy-1,3-benzothiazol-2-yl)-[4-(2-pyridyl)th...)
Show SMILES COc1cccc2sc(Nc3nc(cs3)-c3ccccn3)nc12
Show InChI InChI=1S/C16H12N4OS2/c1-21-12-6-4-7-13-14(12)19-16(23-13)20-15-18-11(9-22-15)10-5-2-3-8-17-10/h2-9H,1H3,(H,18,19,20)
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n/an/an/an/a 1.36E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66024
PNG
((7-chloranylquinolin-4-yl) azepane-1-carboxylate |...)
Show SMILES Clc1ccc2c(OC(=O)N3CCCCCC3)ccnc2c1
Show InChI InChI=1S/C16H17ClN2O2/c17-12-5-6-13-14(11-12)18-8-7-15(13)21-16(20)19-9-3-1-2-4-10-19/h5-8,11H,1-4,9-10H2
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n/an/an/an/a 1.21E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM54724
PNG
(1-anilino-3-phenyl-1H-pyrrole-2,5-dione | 1-anilin...)
Show SMILES O=C1C=C(C(=O)N1Nc1ccccc1)c1ccccc1
Show InChI InChI=1S/C16H12N2O2/c19-15-11-14(12-7-3-1-4-8-12)16(20)18(15)17-13-9-5-2-6-10-13/h1-11,17H
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n/an/an/an/a 1.62E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM61665
PNG
(3-(4-chlorophenyl)-1-(4-methylanilino)pyrrole-2,5-...)
Show SMILES Cc1ccc(NN2C(=O)C=C(C2=O)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C17H13ClN2O2/c1-11-2-8-14(9-3-11)19-20-16(21)10-15(17(20)22)12-4-6-13(18)7-5-12/h2-10,19H,1H3
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n/an/an/an/a 691n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM43210
PNG
(1-(3-nitrophenyl)-3-phenyl-2-propyn-1-one | 1-(3-n...)
Show SMILES [O-][N+](=O)c1cccc(c1)C(=O)C#Cc1ccccc1
Show InChI InChI=1S/C15H9NO3/c17-15(10-9-12-5-2-1-3-6-12)13-7-4-8-14(11-13)16(18)19/h1-8,11H
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n/an/an/an/a 7.75E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM50895
PNG
((4Z)-4-[[5-(2,5-dichlorophenyl)-2-furanyl]methylid...)
Show SMILES CC1=NOC(=O)\C1=C/c1ccc(o1)-c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C15H9Cl2NO3/c1-8-11(15(19)21-18-8)7-10-3-5-14(20-10)12-6-9(16)2-4-13(12)17/h2-7H,1H3/b11-7-
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n/an/an/an/a 2.68E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM33476
PNG
(4-Methyl-benzoic acid 4-{[(E)-4-chloro-phenylimino...)
Show SMILES Cc1ccc(cc1)C(=O)Oc1oc(nc1\C=N\c1ccc(Cl)cc1)-c1ccco1
Show InChI InChI=1S/C22H15ClN2O4/c1-14-4-6-15(7-5-14)21(26)29-22-18(13-24-17-10-8-16(23)9-11-17)25-20(28-22)19-3-2-12-27-19/h2-13H,1H3/b24-13+
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n/an/an/an/a 3.60E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66047
PNG
((3,5-dichloro-2-pyridyl)-[(3-methyl-2-thienyl)meth...)
Show SMILES Cc1ccsc1CN=Nc1ncc(Cl)cc1Cl
Show InChI InChI=1S/C11H9Cl2N3S/c1-7-2-3-17-10(7)6-15-16-11-9(13)4-8(12)5-14-11/h2-5H,6H2,1H3
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n/an/an/an/a 6.19E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM65989
PNG
(2-thiophenecarboxylic acid [(Z)-[1-amino-2-(2,4-di...)
Show SMILES Clc1ccc(CC(=N)NOC(=O)c2cccs2)c(Cl)c1
Show InChI InChI=1S/C13H10Cl2N2O2S/c14-9-4-3-8(10(15)7-9)6-12(16)17-19-13(18)11-2-1-5-20-11/h1-5,7H,6H2,(H2,16,17)
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n/an/an/an/a 4.48E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM55547
PNG
((4Z)-4-[[5-(2-nitrophenyl)-2-furanyl]methylidene]-...)
Show SMILES [O-][N+](=O)c1ccccc1-c1ccc([CH+]c2c([n-]oc2=O)-c2ccccc2)o1
Show InChI InChI=1S/C20H12N2O5/c23-20-16(19(21-27-20)13-6-2-1-3-7-13)12-14-10-11-18(26-14)15-8-4-5-9-17(15)22(24)25/h1-12H
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n/an/an/an/a 5.00E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM65993
PNG
(2-[1-[(E)-2-nitrovinyl]-2-naphthoxy]acetic acid et...)
Show SMILES CCOC(=O)COc1ccc2ccccc2c1\C=C\[N+]([O-])=O
Show InChI InChI=1S/C16H15NO5/c1-2-21-16(18)11-22-15-8-7-12-5-3-4-6-13(12)14(15)9-10-17(19)20/h3-10H,2,11H2,1H3/b10-9+
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n/an/an/an/a 4.41E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66052
PNG
((6E)-6-[[2-[3-chloranyl-5-(trifluoromethyl)pyridin...)
Show SMILES COc1cccc(CN=Nc2ncc(cc2Cl)C(F)(F)F)c1O
Show InChI InChI=1S/C14H11ClF3N3O2/c1-23-11-4-2-3-8(12(11)22)6-20-21-13-10(15)5-9(7-19-13)14(16,17)18/h2-5,7,22H,6H2,1H3
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n/an/an/an/a 6.30E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM576
PNG
(1-Diphenylamino-pyrrole-2,5-dione | MLS000590474 |...)
Show SMILES O=C1C=CC(=O)N1N(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C16H12N2O2/c19-15-11-12-16(20)18(15)17(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12H
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n/an/an/an/a 2.70E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66056
PNG
((E)-3-(4-chloranyl-3-nitro-phenyl)-1-pyridin-3-yl-...)
Show SMILES [O-][N+](=O)c1cc(\C=C\C(=O)c2cccnc2)ccc1Cl
Show InChI InChI=1S/C14H9ClN2O3/c15-12-5-3-10(8-13(12)17(19)20)4-6-14(18)11-2-1-7-16-9-11/h1-9H/b6-4+
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n/an/an/an/a 2.86E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM33165
PNG
(3-chloranyl-4-(3-methoxyphenoxy)-1-(4-methoxypheny...)
Show SMILES COc1ccc(cc1)N1C(=O)C(Cl)=C(Oc2cccc(OC)c2)C1=O
Show InChI InChI=1S/C18H14ClNO5/c1-23-12-8-6-11(7-9-12)20-17(21)15(19)16(18(20)22)25-14-5-3-4-13(10-14)24-2/h3-10H,1-2H3
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n/an/an/an/a 4.89E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM33174
PNG
(2-[[(5Z)-5-(4-bromobenzylidene)-4-keto-2-thiazolin...)
Show SMILES CCOC(=O)CSC1=NC(=O)\C(S1)=C\c1ccc(Br)cc1
Show InChI InChI=1S/C14H12BrNO3S2/c1-2-19-12(17)8-20-14-16-13(18)11(21-14)7-9-3-5-10(15)6-4-9/h3-7H,2,8H2,1H3/b11-7-
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n/an/an/an/a 1.50E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM61536
PNG
(2-chloranyl-4,4-dimethyl-3-oxidanylidene-N-phenyl-...)
Show SMILES CC(C)(C)C(=O)C(Cl)C(=O)Nc1ccccc1
Show InChI InChI=1S/C13H16ClNO2/c1-13(2,3)11(16)10(14)12(17)15-9-7-5-4-6-8-9/h4-8,10H,1-3H3,(H,15,17)
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n/an/an/an/a 1.46E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66061
PNG
((5Z)-2-azanylidene-5-(furan-2-ylmethylidene)-3-(1,...)
Show SMILES N=C1S\C(=C/c2ccco2)C(=O)N1c1nccs1
Show InChI InChI=1S/C11H7N3O2S2/c12-10-14(11-13-3-5-17-11)9(15)8(18-10)6-7-2-1-4-16-7/h1-6,12H/b8-6-,12-10?
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n/an/an/an/a 4.00E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM65455
PNG
(3-methyl-4-nitro-N-(4-pyridin-2-yl-1,3-thiazol-2-y...)
Show SMILES Cc1cc(ccc1[N+]([O-])=O)C(=O)Nc1nc(cs1)-c1ccccn1
Show InChI InChI=1S/C16H12N4O3S/c1-10-8-11(5-6-14(10)20(22)23)15(21)19-16-18-13(9-24-16)12-4-2-3-7-17-12/h2-9H,1H3,(H,18,19,21)
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n/an/an/an/a 6.15E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM65522
PNG
((E)-3-(5-Bromo-2-hydroxy-phenyl)-1-furan-2-yl-prop...)
Show SMILES Oc1ccc(Br)cc1\C=C\C(=O)c1ccco1
Show InChI InChI=1S/C13H9BrO3/c14-10-4-6-11(15)9(8-10)3-5-12(16)13-2-1-7-17-13/h1-8,15H/b5-3+
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n/an/an/an/a>3.30E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM60271
PNG
(5-chloranyl-6-methyl-2-pyridin-2-yl-1H-pyrimidine-...)
Show SMILES Cc1nc([nH]c(=S)c1Cl)-c1ccccn1
Show InChI InChI=1S/C10H8ClN3S/c1-6-8(11)10(15)14-9(13-6)7-4-2-3-5-12-7/h2-5H,1H3,(H,13,14,15)
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n/an/an/an/a 4.58E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM54428
PNG
(2-(4-methylphenyl)sulfonyl-5-nitro-pyridine | 2-(4...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)c1ccc(cn1)[N+]([O-])=O
Show InChI InChI=1S/C12H10N2O4S/c1-9-2-5-11(6-3-9)19(17,18)12-7-4-10(8-13-12)14(15)16/h2-8H,1H3
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n/an/an/an/a 1.49E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66086
PNG
(2-(3-chloranylphenoxy)-N-(4-pyridin-2-yl-1,3-thiaz...)
Show SMILES Clc1cccc(OCC(=O)Nc2nc(cs2)-c2ccccn2)c1
Show InChI InChI=1S/C16H12ClN3O2S/c17-11-4-3-5-12(8-11)22-9-15(21)20-16-19-14(10-23-16)13-6-1-2-7-18-13/h1-8,10H,9H2,(H,19,20,21)
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n/an/an/an/a 1.12E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM64987
PNG
(5-nitro-8-quinolinol | 5-nitroquinolin-8-ol | 8-HY...)
Show SMILES Oc1ccc([N+]([O-])=O)c2cccnc12
Show InChI InChI=1S/C9H6N2O3/c12-8-4-3-7(11(13)14)6-2-1-5-10-9(6)8/h1-5,12H
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n/an/an/an/a 607n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM65005
PNG
(2,4-bis(chloranyl)-N-[(2-phenoxyethanoylamino)carb...)
Show SMILES Clc1ccc(C(=O)NC(=S)NNC(=O)COc2ccccc2)c(Cl)c1
Show InChI InChI=1S/C16H13Cl2N3O3S/c17-10-6-7-12(13(18)8-10)15(23)19-16(25)21-20-14(22)9-24-11-4-2-1-3-5-11/h1-8H,9H2,(H,20,22)(H2,19,21,23,25)
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n/an/an/an/a 1.78E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM47164
PNG
((4,5-dibromo-6-oxopyridazin-1-yl)methyl 4-fluorobe...)
Show SMILES Fc1ccc(cc1)C(=O)OCn1ncc(Br)c(Br)c1=O
Show InChI InChI=1S/C12H7Br2FN2O3/c13-9-5-16-17(11(18)10(9)14)6-20-12(19)7-1-3-8(15)4-2-7/h1-5H,6H2
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n/an/an/an/a 1.91E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM43596
PNG
((3Z)-3-[2-keto-2-(2-thienyl)ethylidene]-7-methyl-o...)
Show SMILES Cc1cccc2\C(=C\C(=O)c3cccs3)C(=O)Nc12
Show InChI InChI=1S/C15H11NO2S/c1-9-4-2-5-10-11(15(18)16-14(9)10)8-12(17)13-6-3-7-19-13/h2-8H,1H3,(H,16,18)/b11-8-
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n/an/an/an/a 5.59E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66029
PNG
(1-naphthalenecarboxylic acid [(Z)-[1-amino-2-(4-ch...)
Show SMILES NC(Cc1ccc(Cl)cc1)=NOC(=O)c1cccc2ccccc12
Show InChI InChI=1S/C19H15ClN2O2/c20-15-10-8-13(9-11-15)12-18(21)22-24-19(23)17-7-3-5-14-4-1-2-6-16(14)17/h1-11H,12H2,(H2,21,22)
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n/an/an/an/a 1.88E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66046
PNG
((3,5-dichloro-2-pyridyl)-[(5-methyl-2-thienyl)meth...)
Show SMILES Cc1ccc(CN=Nc2ncc(Cl)cc2Cl)s1
Show InChI InChI=1S/C11H9Cl2N3S/c1-7-2-3-9(17-7)6-15-16-11-10(13)4-8(12)5-14-11/h2-5H,6H2,1H3
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n/an/an/an/a 3.17E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM60229
PNG
(MLS000568342 | N-[N'-(4-Propoxy-benzoyl)-hydra...)
Show SMILES CCCOc1ccc(cc1)C(=O)NNC(=S)NC(=O)CC
Show InChI InChI=1S/C14H19N3O3S/c1-3-9-20-11-7-5-10(6-8-11)13(19)16-17-14(21)15-12(18)4-2/h5-8H,3-4,9H2,1-2H3,(H,16,19)(H2,15,17,18,21)
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n/an/an/an/a 1.15E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM57360
PNG
((6E)-4-chloranyl-2-nitro-6-[(2-pyridin-2-ylhydrazi...)
Show SMILES [O-][N+](=O)c1cc(Cl)c[c-](C[NH+]=Nc2ccccn2)c1=O
Show InChI InChI=1S/C12H8ClN4O3/c13-9-5-8(12(18)10(6-9)17(19)20)7-15-16-11-3-1-2-4-14-11/h1-6H,7H2/q-1/p+1
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n/an/an/an/a 3.33E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM65129
PNG
(2-({2-nitro-4-[(trifluoromethyl)sulfonyl]phenyl}th...)
Show SMILES [O-][N+](=O)c1cc(ccc1Sc1nc2ccccc2s1)S(=O)(=O)C(F)(F)F
Show InChI InChI=1S/C14H7F3N2O4S3/c15-14(16,17)26(22,23)8-5-6-12(10(7-8)19(20)21)25-13-18-9-3-1-2-4-11(9)24-13/h1-7H
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n/an/an/an/a 8.42E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM54728
PNG
((5E)-1-phenyl-5-[(5-phenylsulfanylfuran-2-yl)methy...)
Show SMILES O=C1NC(=O)C(=Cc2ccc(Sc3ccccc3)o2)C(=O)N1c1ccccc1
Show InChI InChI=1S/C21H14N2O4S/c24-19-17(20(25)23(21(26)22-19)14-7-3-1-4-8-14)13-15-11-12-18(27-15)28-16-9-5-2-6-10-16/h1-13H,(H,22,24,26)
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n/an/an/an/a 1.12E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM65153
PNG
((5,7-dichloroquinolin-8-yl) 3-nitrobenzoate | 3-ni...)
Show SMILES [O-][N+](=O)c1cccc(c1)C(=O)Oc1c(Cl)cc(Cl)c2cccnc12
Show InChI InChI=1S/C16H8Cl2N2O4/c17-12-8-13(18)15(14-11(12)5-2-6-19-14)24-16(21)9-3-1-4-10(7-9)20(22)23/h1-8H
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n/an/an/an/a 2.02E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM50300323
PNG
(1-(4-Hydroxyphenyl)maleimide | CHEMBL565893 | cid_...)
Show SMILES Oc1ccc(cc1)N1C(=O)C=CC1=O
Show InChI InChI=1S/C10H7NO3/c12-8-3-1-7(2-4-8)11-9(13)5-6-10(11)14/h1-6,12H
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n/an/an/an/a 4.09E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66027
PNG
((4-bromophenyl)-[4-(4-methoxy-2-nitro-phenyl)piper...)
Show SMILES COc1ccc(N2CCN(CC2)C(=O)c2ccc(Br)cc2)c(c1)[N+]([O-])=O
Show InChI InChI=1S/C18H18BrN3O4/c1-26-15-6-7-16(17(12-15)22(24)25)20-8-10-21(11-9-20)18(23)13-2-4-14(19)5-3-13/h2-7,12H,8-11H2,1H3
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n/an/an/an/a 1.14E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM50308030
PNG
(5-chloro-7-((4-ethoxyphenyl)(pyridin-3-ylamino)met...)
Show SMILES CCOc1ccc(cc1)C(Nc1cccnc1)c1cc(Cl)c2cccnc2c1O
Show InChI InChI=1S/C23H20ClN3O2/c1-2-29-17-9-7-15(8-10-17)21(27-16-5-3-11-25-14-16)19-13-20(24)18-6-4-12-26-22(18)23(19)28/h3-14,21,27-28H,2H2,1H3
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n/an/an/an/a>3.30E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66006
PNG
((5Z)-1-(4-ethoxyphenyl)-2-sulfanylidene-5-(thiophe...)
Show SMILES CCOc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2cccs2)C1=O
Show InChI InChI=1S/C17H14N2O3S2/c1-2-22-12-7-5-11(6-8-12)19-16(21)14(15(20)18-17(19)23)10-13-4-3-9-24-13/h3-10H,2H2,1H3,(H,18,20,23)
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n/an/an/an/a 1.96E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66009
PNG
((E)-1-(5-Chloro-2-hydroxy-phenyl)-3-(5-chloro-1-me...)
Show SMILES Cn1c(Cl)cnc1\C=C\C(=O)c1cc(Cl)ccc1O
Show InChI InChI=1S/C13H10Cl2N2O2/c1-17-12(15)7-16-13(17)5-4-11(19)9-6-8(14)2-3-10(9)18/h2-7,18H,1H3/b5-4+
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n/an/an/an/a 1.31E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM48098
PNG
((5E)-5-[(4-methoxyphenyl)hydrazinylidene]-8-quinol...)
Show SMILES COc1ccc(cc1)N=Nc1ccc(O)c2ncccc12
Show InChI InChI=1S/C16H13N3O2/c1-21-12-6-4-11(5-7-12)18-19-14-8-9-15(20)16-13(14)3-2-10-17-16/h2-10,20H,1H3
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n/an/an/an/a 6.43E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM50300340
PNG
(1-Biphenyl-3-ylmaleimide | CHEMBL567622 | cid_9309...)
Show SMILES O=C1C=CC(=O)N1c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C16H11NO2/c18-15-9-10-16(19)17(15)14-8-4-7-13(11-14)12-5-2-1-3-6-12/h1-11H
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n/an/an/an/a 385n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM60786
PNG
((4Z)-4-[(5-methyl-2-furanyl)methylidene]-3-(4-meth...)
Show SMILES Cc1ccc(\C=C2/C(=O)ON=C2c2ccc(C)cc2)o1
Show InChI InChI=1S/C16H13NO3/c1-10-3-6-12(7-4-10)15-14(16(18)20-17-15)9-13-8-5-11(2)19-13/h3-9H,1-2H3/b14-9-
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n/an/an/an/a 4.47E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66013
PNG
((5E)-1-(4-methoxyphenyl)-2-sulfanylidene-5-(thioph...)
Show SMILES COc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2cccs2)C1=O
Show InChI InChI=1S/C16H12N2O3S2/c1-21-11-6-4-10(5-7-11)18-15(20)13(14(19)17-16(18)22)9-12-3-2-8-23-12/h2-9H,1H3,(H,17,19,22)
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n/an/an/an/a 1.32E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM47478
PNG
(2-(4-chlorophenyl)sulfonyl-6-methoxy-3-nitro-pyrid...)
Show SMILES COc1ccc(c(n1)S(=O)(=O)c1ccc(Cl)cc1)[N+]([O-])=O
Show InChI InChI=1S/C12H9ClN2O5S/c1-20-11-7-6-10(15(16)17)12(14-11)21(18,19)9-4-2-8(13)3-5-9/h2-7H,1H3
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n/an/an/an/a 1.99E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM11296
PNG
(2-(benzenesulfonyl)-4,6-dimethyl-5-nitropyridine-3...)
Show SMILES Cc1nc(c(C#N)c(C)c1[N+]([O-])=O)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C14H11N3O4S/c1-9-12(8-15)14(16-10(2)13(9)17(18)19)22(20,21)11-6-4-3-5-7-11/h3-7H,1-2H3
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n/an/an/an/a 6.31E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66015
PNG
(5-nitro-2-[3-(trifluoromethyl)phenyl]sulfonyl-pyri...)
Show SMILES [O-][N+](=O)c1ccc(nc1)S(=O)(=O)c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C12H7F3N2O4S/c13-12(14,15)8-2-1-3-10(6-8)22(20,21)11-5-4-9(7-16-11)17(18)19/h1-7H
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n/an/an/an/a 2.15E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM60286
PNG
(3-bromanyl-N-(1-pyridin-2-ylethylideneamino)benzam...)
Show SMILES CC(=NNC(=O)c1cccc(Br)c1)c1ccccn1
Show InChI InChI=1S/C14H12BrN3O/c1-10(13-7-2-3-8-16-13)17-18-14(19)11-5-4-6-12(15)9-11/h2-9H,1H3,(H,18,19)
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n/an/an/an/a>3.30E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM66087
PNG
(2-aminoethanol;6-cyclohexyl-1-hydroxy-4-methyl-2-p...)
Show SMILES Cc1cc(C2CCCCC2)n(O)c(=O)c1
Show InChI InChI=1S/C12H17NO2/c1-9-7-11(13(15)12(14)8-9)10-5-3-2-4-6-10/h7-8,10,15H,2-6H2,1H3
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UniChem

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n/an/an/an/a 5.34E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM60985
PNG
(1-hydroxy-2-pyridinethione | 1-hydroxypyridine-2-t...)
Show SMILES On1ccccc1=S
Show InChI InChI=1S/C5H5NOS/c7-6-4-2-1-3-5(6)8/h1-4,7H
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n/an/an/an/a 8.92E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
LAP4


(Saccharomyces cerevisiae)
BDBM41480
PNG
(1-[4-[4-(4-bromobenzoyl)piperazin-1-yl]-3-fluoroph...)
Show SMILES CC(=O)c1ccc(N2CCN(CC2)C(=O)c2ccc(Br)cc2)c(F)c1
Show InChI InChI=1S/C19H18BrFN2O2/c1-13(24)15-4-7-18(17(21)12-15)22-8-10-23(11-9-22)19(25)14-2-5-16(20)6-3-14/h2-7,12H,8-11H2,1H3
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n/an/an/an/a 9.91E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
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* indicates data uncertainty>20%