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Compile Data Set for Download or QSAR

Found 88 hits Enz. Inhib. hit(s) with all data for entry = 7379   
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
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM50069799
PNG
(CHEMBL3407579 | US9187441, 7M)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1cc(F)c(F)c(F)c1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H21ClF3N3O4/c1-23(2,3)29-21(32)20(30(10-31)9-11-6-14(25)18(27)15(26)7-11)17-13-5-4-12(24)8-16(13)28-19(17)22(33)34/h4-8,10,20,28H,9H2,1-3H3,(H,29,32)(H,33,34)
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US Patent
0.130 -55.5n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192221
PNG
(US9187441, 7K)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1ccc(F)c(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H21ClF3N3O4/c1-23(2,3)29-21(32)20(30(10-31)9-11-4-7-14(25)18(27)17(11)26)16-13-6-5-12(24)8-15(13)28-19(16)22(33)34/h4-8,10,20,28H,9H2,1-3H3,(H,29,32)(H,33,34)
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US Patent
0.150 -55.1n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192225
PNG
(US9187441, 7P)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1cc(F)cc(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H21ClF3N3O4/c1-23(2,3)29-21(32)20(30(10-31)9-11-6-13(25)8-15(26)18(11)27)17-14-5-4-12(24)7-16(14)28-19(17)22(33)34/h4-8,10,20,28H,9H2,1-3H3,(H,29,32)(H,33,34)
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US Patent
0.170 -54.8n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192217
PNG
(US9187441, 7G)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1cccc(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H22ClF2N3O4/c1-23(2,3)28-21(31)20(29(11-30)10-12-5-4-6-15(25)18(12)26)17-14-8-7-13(24)9-16(14)27-19(17)22(32)33/h4-9,11,20,27H,10H2,1-3H3,(H,28,31)(H,32,33)
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0.200 -54.4n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192155
PNG
(US9187441, 7E)
Show SMILES CCOC(=O)c1c(C(N(Cc2ccccc2)C(C)=O)C(=O)NC2CCCCC2)c2ccc(Cl)cc2n1C(=O)OC(C)(C)C
Show InChI InChI=1S/C33H40ClN3O6/c1-6-42-31(40)29-27(25-18-17-23(34)19-26(25)37(29)32(41)43-33(3,4)5)28(30(39)35-24-15-11-8-12-16-24)36(21(2)38)20-22-13-9-7-10-14-22/h7,9-10,13-14,17-19,24,28H,6,8,11-12,15-16,20H2,1-5H3,(H,35,39)
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0.25 -53.9n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192161
PNG
(US9187441, 7I)
Show SMILES CCOC(=O)c1c(C(N(Cc2ccccc2)C=O)C(=O)NC2CCCCC2)c2ccc(Cl)cc2n1C(=O)OC(C)(C)C
Show InChI InChI=1S/C32H38ClN3O6/c1-5-41-30(39)28-26(24-17-16-22(33)18-25(24)36(28)31(40)42-32(2,3)4)27(29(38)34-23-14-10-7-11-15-23)35(20-37)19-21-12-8-6-9-13-21/h6,8-9,12-13,16-18,20,23,27H,5,7,10-11,14-15,19H2,1-4H3,(H,34,38)
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0.300 -53.4n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192204
PNG
(US9187441, 6M)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)c(F)c(F)c1)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H25ClF3N3O4/c1-5-36-24(35)21-19(15-7-6-14(26)10-18(15)30-21)22(23(34)31-25(2,3)4)32(12-33)11-13-8-16(27)20(29)17(28)9-13/h6-10,12,22,30H,5,11H2,1-4H3,(H,31,34)
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0.400 -52.7n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192213
PNG
(US9187441, 7B)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1ccc(F)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H23ClFN3O4/c1-23(2,3)27-21(30)20(28(12-29)11-13-4-7-15(25)8-5-13)18-16-9-6-14(24)10-17(16)26-19(18)22(31)32/h4-10,12,20,26H,11H2,1-3H3,(H,27,30)(H,31,32)
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0.450 -52.5n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192196
PNG
(US9187441, 6E)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(F)c(F)c1)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H26ClF2N3O4/c1-5-35-24(34)21-20(16-8-7-15(26)11-19(16)29-21)22(23(33)30-25(2,3)4)31(13-32)12-14-6-9-17(27)18(28)10-14/h6-11,13,22,29H,5,12H2,1-4H3,(H,30,33)
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0.5 -52.2n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192228
PNG
(US9187441, 7S)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1cc(F)c(F)c(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H20ClF4N3O4/c1-23(2,3)30-21(33)20(15-12-5-4-11(24)7-14(12)29-19(15)22(34)35)31(9-32)8-10-6-13(25)17(27)18(28)16(10)26/h4-7,9,20,29H,8H2,1-3H3,(H,30,33)(H,34,35)
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US Patent
0.700 -51.4n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192151
PNG
(US9187441, 7C)
Show SMILES CCOC(=O)c1c(C(N(CC(C)C)C(C)=O)C(=O)NCc2ccccc2)c2ccc(Cl)cc2n1C(=O)OC(C)(C)C
Show InChI InChI=1S/C31H38ClN3O6/c1-8-40-29(38)27-25(23-15-14-22(32)16-24(23)35(27)30(39)41-31(5,6)7)26(34(20(4)36)18-19(2)3)28(37)33-17-21-12-10-9-11-13-21/h9-16,19,26H,8,17-18H2,1-7H3,(H,33,37)
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0.810 -51.0n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192194
PNG
(US9187441, 6C)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cccc(F)c1)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H27ClFN3O4/c1-5-34-24(33)21-20(18-10-9-16(26)12-19(18)28-21)22(23(32)29-25(2,3)4)30(14-31)13-15-7-6-8-17(27)11-15/h6-12,14,22,28H,5,13H2,1-4H3,(H,29,32)
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US Patent
1.30 -49.9n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192241
PNG
(US9187441, 6A)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccccc1)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H28ClN3O4/c1-5-33-24(32)21-20(18-12-11-17(26)13-19(18)27-21)22(23(31)28-25(2,3)4)29(15-30)14-16-9-7-6-8-10-16/h6-13,15,22,27H,5,14H2,1-4H3,(H,28,31)
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1.5 -49.5n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192153
PNG
(US9187441, 7D)
Show SMILES CCOC(=O)c1c(C(N(Cc2ccccc2)C(C)=O)C(=O)NCc2ccccc2)c2ccc(Cl)cc2n1C(=O)OC(C)(C)C
Show InChI InChI=1S/C34H36ClN3O6/c1-6-43-32(41)30-28(26-18-17-25(35)19-27(26)38(30)33(42)44-34(3,4)5)29(31(40)36-20-23-13-9-7-10-14-23)37(22(2)39)21-24-15-11-8-12-16-24/h7-19,29H,6,20-21H2,1-5H3,(H,36,40)
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US Patent
1.70 -49.2n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192148
PNG
(US9187441, 7A)
Show SMILES CC(C)CN(C(C(=O)NCc1ccccc1)c1cn(C(=O)OC(C)(C)C)c2ccccc12)C(C)=O
Show InChI InChI=1S/C28H35N3O4/c1-19(2)17-30(20(3)32)25(26(33)29-16-21-12-8-7-9-13-21)23-18-31(27(34)35-28(4,5)6)24-15-11-10-14-22(23)24/h7-15,18-19,25H,16-17H2,1-6H3,(H,29,33)
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1.80 -49.1n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192229
PNG
(US9187441, 7T)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1c(F)c(F)c(F)c(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H19ClF5N3O4/c1-23(2,3)31-21(34)20(13-10-5-4-9(24)6-12(10)30-19(13)22(35)36)32(8-33)7-11-14(25)16(27)18(29)17(28)15(11)26/h4-6,8,20,30H,7H2,1-3H3,(H,31,34)(H,35,36)
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1.80 -49.1n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192202
PNG
(US9187441, 6K)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(F)c(F)c1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H25ClF3N3O4/c1-5-36-24(35)21-18(15-8-7-14(26)10-17(15)30-21)22(23(34)31-25(2,3)4)32(12-33)11-13-6-9-16(27)20(29)19(13)28/h6-10,12,22,30H,5,11H2,1-4H3,(H,31,34)
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US Patent
2.10 -48.7n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192193
PNG
(US9187441, 6B)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(F)cc1)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H27ClFN3O4/c1-5-34-24(33)21-20(18-11-8-16(26)12-19(18)28-21)22(23(32)29-25(2,3)4)30(14-31)13-15-6-9-17(27)10-7-15/h6-12,14,22,28H,5,13H2,1-4H3,(H,29,32)
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2.20 -48.6n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192216
PNG
(US9187441, 7F)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1ccc(F)cc1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H22ClF2N3O4/c1-23(2,3)28-21(31)20(29(11-30)10-12-4-6-14(25)9-16(12)26)18-15-7-5-13(24)8-17(15)27-19(18)22(32)33/h4-9,11,20,27H,10H2,1-3H3,(H,28,31)(H,32,33)
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US Patent
2.30 -48.5n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192222
PNG
(US9187441, 7L)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1cc(F)c(F)cc1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H21ClF3N3O4/c1-23(2,3)29-21(32)20(30(10-31)9-11-6-15(26)16(27)8-14(11)25)18-13-5-4-12(24)7-17(13)28-19(18)22(33)34/h4-8,10,20,28H,9H2,1-3H3,(H,29,32)(H,33,34)
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US Patent
2.30 -48.5n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192200
PNG
(US9187441, 6I)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)cc(F)c1)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H26ClF2N3O4/c1-5-35-24(34)21-20(18-7-6-15(26)10-19(18)29-21)22(23(33)30-25(2,3)4)31(13-32)12-14-8-16(27)11-17(28)9-14/h6-11,13,22,29H,5,12H2,1-4H3,(H,30,33)
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2.40 -48.4n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192207
PNG
(US9187441, 6P)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)cc(F)c1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H25ClF3N3O4/c1-5-36-24(35)21-19(16-7-6-14(26)9-18(16)30-21)22(23(34)31-25(2,3)4)32(12-33)11-13-8-15(27)10-17(28)20(13)29/h6-10,12,22,30H,5,11H2,1-4H3,(H,31,34)
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2.5 -48.3n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192159
PNG
(US9187441, 7H)
Show SMILES CCCC(=O)N(Cc1ccccc1)C(C(=O)NC1CCCCC1)c1c(C(=O)OCC)n(C(=O)OC(C)(C)C)c2cc(Cl)ccc12
Show InChI InChI=1S/C35H44ClN3O6/c1-6-14-28(40)38(22-23-15-10-8-11-16-23)30(32(41)37-25-17-12-9-13-18-25)29-26-20-19-24(36)21-27(26)39(31(29)33(42)44-7-2)34(43)45-35(3,4)5/h8,10-11,15-16,19-21,25,30H,6-7,9,12-14,17-18,22H2,1-5H3,(H,37,41)
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2.5 -48.3n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192198
PNG
(US9187441, 6G)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cccc(F)c1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H26ClF2N3O4/c1-5-35-24(34)21-19(16-10-9-15(26)11-18(16)29-21)22(23(33)30-25(2,3)4)31(13-32)12-14-7-6-8-17(27)20(14)28/h6-11,13,22,29H,5,12H2,1-4H3,(H,30,33)
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3 -47.8n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192195
PNG
(US9187441, 6D)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccccc1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H27ClFN3O4/c1-5-34-24(33)21-20(17-11-10-16(26)12-19(17)28-21)22(23(32)29-25(2,3)4)30(14-31)13-15-8-6-7-9-18(15)27/h6-12,14,22,28H,5,13H2,1-4H3,(H,29,32)
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3 -47.8n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192226
PNG
(US9187441, 7Q)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1c(F)c(F)cc(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H20ClF4N3O4/c1-23(2,3)30-21(33)20(16-11-5-4-10(24)6-15(11)29-19(16)22(34)35)31(9-32)8-12-17(27)13(25)7-14(26)18(12)28/h4-7,9,20,29H,8H2,1-3H3,(H,30,33)(H,34,35)
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3 -47.8n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192227
PNG
(US9187441, 7R)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1c(F)cc(F)c(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H20ClF4N3O4/c1-23(2,3)30-21(33)20(16-11-5-4-10(24)6-15(11)29-19(16)22(34)35)31(9-32)8-12-13(25)7-14(26)18(28)17(12)27/h4-7,9,20,29H,8H2,1-3H3,(H,30,33)(H,34,35)
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3 -47.8n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192223
PNG
(US9187441, 7N)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1c(F)ccc(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H21ClF3N3O4/c1-23(2,3)29-21(32)20(30(10-31)9-13-14(25)6-7-15(26)18(13)27)17-12-5-4-11(24)8-16(12)28-19(17)22(33)34/h4-8,10,20,28H,9H2,1-3H3,(H,29,32)(H,33,34)
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3.20 -47.7n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192224
PNG
(US9187441, 7O)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1c(F)cc(F)cc1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H21ClF3N3O4/c1-23(2,3)29-21(32)20(30(10-31)9-14-15(26)7-12(25)8-16(14)27)18-13-5-4-11(24)6-17(13)28-19(18)22(33)34/h4-8,10,20,28H,9H2,1-3H3,(H,29,32)(H,33,34)
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3.20 -47.7n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192205
PNG
(US9187441, 6N)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1c(F)ccc(F)c1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H25ClF3N3O4/c1-5-36-24(35)21-19(14-7-6-13(26)10-18(14)30-21)22(23(34)31-25(2,3)4)32(12-33)11-15-16(27)8-9-17(28)20(15)29/h6-10,12,22,30H,5,11H2,1-4H3,(H,31,34)
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4.30 -47.0n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192201
PNG
(US9187441, 6J)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1c(F)cccc1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H26ClF2N3O4/c1-5-35-24(34)21-20(15-10-9-14(26)11-19(15)29-21)22(23(33)30-25(2,3)4)31(13-32)12-16-17(27)7-6-8-18(16)28/h6-11,13,22,29H,5,12H2,1-4H3,(H,30,33)
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4.5 -46.8n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192203
PNG
(US9187441, 6L)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)c(F)cc1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H25ClF3N3O4/c1-5-36-24(35)21-20(15-7-6-14(26)9-19(15)30-21)22(23(34)31-25(2,3)4)32(12-33)11-13-8-17(28)18(29)10-16(13)27/h6-10,12,22,30H,5,11H2,1-4H3,(H,31,34)
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5 -46.6n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192220
PNG
(US9187441, 7J)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1c(F)cccc1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H22ClF2N3O4/c1-23(2,3)28-21(31)20(29(11-30)10-14-15(25)5-4-6-16(14)26)18-13-8-7-12(24)9-17(13)27-19(18)22(32)33/h4-9,11,20,27H,10H2,1-3H3,(H,28,31)(H,32,33)
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5.70 -46.3n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192209
PNG
(US9187441, 6R)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1c(F)cc(F)c(F)c1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H24ClF4N3O4/c1-5-37-24(36)21-18(13-7-6-12(26)8-17(13)31-21)22(23(35)32-25(2,3)4)33(11-34)10-14-15(27)9-16(28)20(30)19(14)29/h6-9,11,22,31H,5,10H2,1-4H3,(H,32,35)
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5.80 -46.2n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192211
PNG
(US9187441, 6T)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1c(F)c(F)c(F)c(F)c1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H23ClF5N3O4/c1-5-38-24(37)21-15(12-7-6-11(26)8-14(12)32-21)22(23(36)33-25(2,3)4)34(10-35)9-13-16(27)18(29)20(31)19(30)17(13)28/h6-8,10,22,32H,5,9H2,1-4H3,(H,33,36)
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5.80 -46.2n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192197
PNG
(US9187441, 6F)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(F)cc1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H26ClF2N3O4/c1-5-35-24(34)21-20(17-9-7-15(26)10-19(17)29-21)22(23(33)30-25(2,3)4)31(13-32)12-14-6-8-16(27)11-18(14)28/h6-11,13,22,29H,5,12H2,1-4H3,(H,30,33)
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6 -46.1n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192208
PNG
(US9187441, 6Q)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1c(F)c(F)cc(F)c1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H24ClF4N3O4/c1-5-37-24(36)21-18(13-7-6-12(26)8-17(13)31-21)22(23(35)32-25(2,3)4)33(11-34)10-14-19(29)15(27)9-16(28)20(14)30/h6-9,11,22,31H,5,10H2,1-4H3,(H,32,35)
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6.70 -45.9n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192206
PNG
(US9187441, 6O)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1c(F)cc(F)cc1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H25ClF3N3O4/c1-5-36-24(35)21-20(15-7-6-13(26)8-19(15)30-21)22(23(34)31-25(2,3)4)32(12-33)11-16-17(28)9-14(27)10-18(16)29/h6-10,12,22,30H,5,11H2,1-4H3,(H,31,34)
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6.80 -45.8n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192210
PNG
(US9187441, 6S)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)c(F)c(F)c1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H24ClF4N3O4/c1-5-37-24(36)21-17(14-7-6-13(26)9-16(14)31-21)22(23(35)32-25(2,3)4)33(11-34)10-12-8-15(27)19(29)20(30)18(12)28/h6-9,11,22,31H,5,10H2,1-4H3,(H,32,35)
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7 -45.8n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192199
PNG
(US9187441, 6H)
Show SMILES CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)ccc1F)C=O)C(=O)NC(C)(C)C
Show InChI InChI=1S/C25H26ClF2N3O4/c1-5-35-24(34)21-20(17-8-6-15(26)11-19(17)29-21)22(23(33)30-25(2,3)4)31(13-32)12-14-10-16(27)7-9-18(14)28/h6-11,13,22,29H,5,12H2,1-4H3,(H,30,33)
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10 -44.9n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM50014092
PNG
(CHEMBL3259830 | US9187441, 9l)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1ccc(Cl)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H23Cl2N3O4/c1-23(2,3)27-21(30)20(28(12-29)11-13-4-6-14(24)7-5-13)18-16-9-8-15(25)10-17(16)26-19(18)22(31)32/h4-10,12,20,26H,11H2,1-3H3,(H,27,30)(H,31,32)
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300 -36.6n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM50014092
PNG
(CHEMBL3259830 | US9187441, 9l)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1ccc(Cl)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H23Cl2N3O4/c1-23(2,3)27-21(30)20(28(12-29)11-13-4-6-14(24)7-5-13)18-16-9-8-15(25)10-17(16)26-19(18)22(31)32/h4-10,12,20,26H,11H2,1-3H3,(H,27,30)(H,31,32)
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400 -35.9n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192240
PNG
(US9187441, KK273)
Show SMILES CC(C)CC(NC(C(=O)NCc1ccccc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C30H38ClN5O5/c1-19(2)16-24(28(37)32-10-11-36-12-14-41-15-13-36)35-26(29(38)33-18-20-6-4-3-5-7-20)25-22-9-8-21(31)17-23(22)34-27(25)30(39)40/h3-9,17,19,24,26,34-35H,10-16,18H2,1-2H3,(H,32,37)(H,33,38)(H,39,40)
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400 -35.2n/an/an/an/an/a7.414



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
All NMR spectra were acquired at 298 K on a Bruker DRX 600 MHz spectrometer equipped with a cryoprobe. Typically, NMR samples contained 0.1-0.2 mM pr...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192179
PNG
(US9187441, 9n)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1ccc(Cl)cc1Cl)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H22Cl3N3O4/c1-23(2,3)28-21(31)20(29(11-30)10-12-4-5-13(24)8-16(12)26)18-15-7-6-14(25)9-17(15)27-19(18)22(32)33/h4-9,11,20,27H,10H2,1-3H3,(H,28,31)(H,32,33)
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500 -35.4n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192178
PNG
(US9187441, 9m)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1ccc(Cl)c(Cl)c1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H22Cl3N3O4/c1-23(2,3)28-21(31)20(29(11-30)10-12-4-7-15(25)16(26)8-12)18-14-6-5-13(24)9-17(14)27-19(18)22(32)33/h4-9,11,20,27H,10H2,1-3H3,(H,28,31)(H,32,33)
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600 -34.9n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM50014092
PNG
(CHEMBL3259830 | US9187441, 9l)
Show SMILES CC(C)(C)NC(=O)C(N(Cc1ccc(Cl)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C23H23Cl2N3O4/c1-23(2,3)27-21(30)20(28(12-29)11-13-4-6-14(24)7-5-13)18-16-9-8-15(25)10-17(16)26-19(18)22(31)32/h4-10,12,20,26H,11H2,1-3H3,(H,27,30)(H,31,32)
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700 -34.5n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192244
PNG
(US9187441, 11b)
Show SMILES CC(C)(C)NC(=O)C(NCc1ccc(Cl)cc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C22H23Cl2N3O3/c1-22(2,3)27-20(28)18(25-11-12-4-6-13(23)7-5-12)17-15-9-8-14(24)10-16(15)26-19(17)21(29)30/h4-10,18,25-26H,11H2,1-3H3,(H,27,28)(H,29,30)
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700 -34.5n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192182
PNG
(US9187441, 9q)
Show SMILES C[C@@H](N(C=O)C(C(=O)NC(C)(C)C)c1c([nH]c2cc(Cl)ccc12)C(O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H25Cl2N3O4/c1-13(14-5-7-15(25)8-6-14)29(12-30)21(22(31)28-24(2,3)4)19-17-10-9-16(26)11-18(17)27-20(19)23(32)33/h5-13,21,27H,1-4H3,(H,28,31)(H,32,33)/t13-,21?/m1/s1
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900 -33.9n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192243
PNG
(US9187441, 11a)
Show SMILES OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCc1ccccc1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C24H26ClN3O3/c25-16-11-12-18-19(13-16)28-22(24(30)31)20(18)21(26-14-15-7-3-1-4-8-15)23(29)27-17-9-5-2-6-10-17/h1,3-4,7-8,11-13,17,21,26,28H,2,5-6,9-10,14H2,(H,27,29)(H,30,31)
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900 -33.9n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM192239
PNG
(US9187441, KK271)
Show SMILES CC(C)CC(NC(C(=O)NCc1ccccc1)c1c([nH]c2cc(Cl)ccc12)C(=O)NO)C(=O)NO
Show InChI InChI=1S/C24H28ClN5O5/c1-13(2)10-18(22(31)29-34)28-20(23(32)26-12-14-6-4-3-5-7-14)19-16-9-8-15(25)11-17(16)27-21(19)24(33)30-35/h3-9,11,13,18,20,27-28,34-35H,10,12H2,1-2H3,(H,26,32)(H,29,31)(H,30,33)
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900 -33.9n/an/an/an/an/an/a20



University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Fluorescent polarization experiments were performed as follows. Briefly, the fluorescence polarization experiments were read on an Ultra Evolution 38...


US Patent US9187441 (2015)


BindingDB Entry DOI: 10.7270/Q2DR2T9N
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
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