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18 similar compounds to monomer 161578

Compile data set for download or QSAR
Wt: 653.7
BDBM161511
Wt: 738.8
BDBM161513
Wt: 772.8
BDBM161523
Wt: 644.1
BDBM161532
Wt: 722.8
BDBM161533
Wt: 729.2
BDBM161538
Wt: 742.3
BDBM161553
Wt: 742.8
BDBM161564
Wt: 712.8
BDBM161570
Wt: 759.3
BDBM161579
Wt: 694.8
BDBM161593
Wt: 713.2
BDBM161575
Wt: 703.2
BDBM161577
Wt: 745.3
BDBM161596
Wt: 698.1
BDBM161613
Displayed 1 to 15 (of 18 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 161511,161513,161523,161532,161533,161538,161553,161564,161570,161579,161593,161575,161577,161596,161613   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161511
PNG
(US9108983, Example 42)
Show SMILES C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2cnc3n(C)ccc3c2)c(C)n1C
Show InChI InChI=1S/C39H35N5O5/c1-23-15-25-7-5-6-8-27(25)21-43(23)38(46)33-19-36-35(48-22-49-36)18-32(33)34-17-31(24(2)42(34)4)39(47)44(28-9-11-30(45)12-10-28)29-16-26-13-14-41(3)37(26)40-20-29/h5-14,16-20,23,45H,15,21-22H2,1-4H3/t23-/m1/s1
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n/an/a 5.20n/an/an/an/a7.4n/a



LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD

US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161613
PNG
(US9108983, Example 430)
Show SMILES Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3CC2C(F)(F)F)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2n(C)ccc2c1
Show InChI InChI=1S/C38H31ClF3N5O3/c1-22-31(37(50)47(27-9-11-29(48)12-10-27)28-16-24-14-15-44(2)35(24)43-20-28)19-33(45(22)3)32-18-26(39)8-13-30(32)36(49)46-21-25-7-5-4-6-23(25)17-34(46)38(40,41)42/h4-16,18-20,34,48H,17,21H2,1-3H3
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n/an/a 19.9n/an/an/an/a7.4n/a



LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD

US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161523
PNG
(US9108983, Example 54)
Show SMILES C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(CNC(=O)COc2ccccc2)cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2cnc3n(C)ccc3c2)c(C)n1C
Show InChI InChI=1S/C47H44N6O5/c1-30-22-33-10-8-9-11-35(33)28-52(30)46(56)40-19-14-32(26-48-44(55)29-58-39-12-6-5-7-13-39)23-42(40)43-25-41(31(2)51(43)4)47(57)53(36-15-17-38(54)18-16-36)37-24-34-20-21-50(3)45(34)49-27-37/h5-21,23-25,27,30,54H,22,26,28-29H2,1-4H3,(H,48,55)/t30-/m1/s1
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n/an/a 18n/an/an/an/a7.4n/a



LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD

US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161532
PNG
(US9108983, Example 63)
Show SMILES C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2cnc3n(C)ccc3c2)c(C)n1C
Show InChI InChI=1S/C38H34ClN5O3/c1-23-17-25-7-5-6-8-27(25)22-43(23)37(46)32-14-9-28(39)19-34(32)35-20-33(24(2)42(35)4)38(47)44(29-10-12-31(45)13-11-29)30-18-26-15-16-41(3)36(26)40-21-30/h5-16,18-21,23,45H,17,22H2,1-4H3/t23-/m1/s1
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n/an/a 5.10n/an/an/an/a7.4n/a



LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD

US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161533
PNG
(US9108983, Example 65)
Show SMILES Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccccc1)c1cnc2n(C)ccc2c1
Show InChI InChI=1S/C43H42N6O5/c1-28-35(43(51)49(32-11-5-4-6-12-32)33-20-30-13-14-45(2)41(30)44-24-33)21-38(46(28)3)36-22-39-40(54-27-53-39)23-37(36)42(50)48-25-31-10-8-7-9-29(31)19-34(48)26-47-15-17-52-18-16-47/h4-14,20-24,34H,15-19,25-27H2,1-3H3/t34-/m0/s1
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n/an/a 21.9n/an/an/an/a7.4n/a



LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD

US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161538
PNG
(US9108983, Example 74)
Show SMILES Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2n(C)ccc2c1
Show InChI InChI=1S/C42H41ClN6O4/c1-27-37(42(52)49(32-9-11-35(50)12-10-32)33-21-29-14-15-45(2)40(29)44-24-33)23-39(46(27)3)38-22-31(43)8-13-36(38)41(51)48-25-30-7-5-4-6-28(30)20-34(48)26-47-16-18-53-19-17-47/h4-15,21-24,34,50H,16-20,25-26H2,1-3H3/t34-/m0/s1
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n/an/a 6.10n/an/an/an/a7.4n/a



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US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161553
PNG
(US9108983, Example 102)
Show SMILES CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Cl)cc2-c2cc(C(=O)N(c3ccc(O)cc3)c3cnc4n(C)ccc4c3)c(C)n2C)CC1
Show InChI InChI=1S/C43H44ClN7O3/c1-28-38(43(54)51(33-10-12-36(52)13-11-33)34-22-30-15-16-47(3)41(30)45-25-34)24-40(48(28)4)39-23-32(44)9-14-37(39)42(53)50-26-31-8-6-5-7-29(31)21-35(50)27-49-19-17-46(2)18-20-49/h5-16,22-25,35,52H,17-21,26-27H2,1-4H3/t35-/m0/s1
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n/an/a 2n/an/an/an/a7.4n/a



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US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161564
PNG
(US9108983, Example 209)
Show SMILES COc1cc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(cc1F)-c1cc(C(=O)N(c2ccc(O)cc2)c2cnc3n(C)ccc3c2)c(C)n1C
Show InChI InChI=1S/C43H43FN6O5/c1-27-35(43(53)50(31-9-11-34(51)12-10-31)32-20-29-13-14-46(2)41(29)45-24-32)22-39(47(27)3)36-21-38(44)40(54-4)23-37(36)42(52)49-25-30-8-6-5-7-28(30)19-33(49)26-48-15-17-55-18-16-48/h5-14,20-24,33,51H,15-19,25-26H2,1-4H3/t33-/m0/s1
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n/an/a 7.40n/an/an/an/a7.4n/a



LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD

US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161570
PNG
(US9108983, Example 385)
Show SMILES Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2n(C)ccc2c1
Show InChI InChI=1S/C42H41FN6O4/c1-27-37(42(52)49(32-9-11-35(50)12-10-32)33-21-29-14-15-45(2)40(29)44-24-33)23-39(46(27)3)38-22-31(43)8-13-36(38)41(51)48-25-30-7-5-4-6-28(30)20-34(48)26-47-16-18-53-19-17-47/h4-15,21-24,34,50H,16-20,25-26H2,1-3H3/t34-/m0/s1
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n/an/a 5.70n/an/an/an/a7.4n/a



LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD

US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161575
PNG
(US9108983, Example 390)
Show SMILES Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccccc1)c1cnc2n(C)ccc2c1
Show InChI InChI=1S/C42H41ClN6O3/c1-28-37(42(51)49(33-11-5-4-6-12-33)34-22-30-15-16-45(2)40(30)44-25-34)24-39(46(28)3)38-23-32(43)13-14-36(38)41(50)48-26-31-10-8-7-9-29(31)21-35(48)27-47-17-19-52-20-18-47/h4-16,22-25,35H,17-21,26-27H2,1-3H3/t35-/m0/s1
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n/an/a 21.2n/an/an/an/a7.4n/a



LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD

US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161577
PNG
(US9108983, Example 392)
Show SMILES Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CCCN2CCOCC2)n1C)C(=O)N(c1ccccc1)c1ccc(O)cc1
Show InChI InChI=1S/C42H43ClN4O4/c1-29-38(42(50)47(33-11-4-3-5-12-33)34-15-17-36(48)18-16-34)27-40(44(29)2)39-26-32(43)14-19-37(39)41(49)46-28-31-10-7-6-9-30(31)25-35(46)13-8-20-45-21-23-51-24-22-45/h3-7,9-12,14-19,26-27,35,48H,8,13,20-25,28H2,1-2H3/t35-/m1/s1
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n/an/a 3.80n/an/an/an/a7.4n/a



LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD

US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161579
PNG
(US9108983, Example 394)
Show SMILES CN1CCc2cc(cnc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CCCN2CCOCC2)n(C)c1C)c1ccc(O)cc1
Show InChI InChI=1S/C44H47ClN6O4/c1-29-39(44(54)51(34-11-13-37(52)14-12-34)36-24-31-16-18-47(2)42(31)46-27-36)26-41(48(29)3)40-25-33(45)10-15-38(40)43(53)50-28-32-8-5-4-7-30(32)23-35(50)9-6-17-49-19-21-55-22-20-49/h4-5,7-8,10-15,24-27,35,52H,6,9,16-23,28H2,1-3H3/t35-/m1/s1
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n/an/a 2.5n/an/an/an/a7.4n/a



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US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161593
PNG
(US9108983, Example 409)
Show SMILES Cc1c(cc(-c2ccccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2n(C)ccc2c1
Show InChI InChI=1S/C42H42N6O4/c1-28-38(42(51)48(32-12-14-35(49)15-13-32)33-23-30-16-17-44(2)40(30)43-25-33)24-39(45(28)3)36-10-6-7-11-37(36)41(50)47-26-31-9-5-4-8-29(31)22-34(47)27-46-18-20-52-21-19-46/h4-17,23-25,34,49H,18-22,26-27H2,1-3H3/t34-/m0/s1
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n/an/a 12.2n/an/an/an/a7.4n/a



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US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161596
PNG
(US9108983, Example 412)
Show SMILES Cc1c(cc(C#N)n1C)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CCCN2CCOCC2)n(C)c1C)c1ccc(O)cc1
Show InChI InChI=1S/C43H45ClN6O4/c1-28-38(43(53)50(33-12-14-36(51)15-13-33)40-24-35(26-45)46(3)29(40)2)25-41(47(28)4)39-23-32(44)11-16-37(39)42(52)49-27-31-9-6-5-8-30(31)22-34(49)10-7-17-48-18-20-54-21-19-48/h5-6,8-9,11-16,23-25,34,51H,7,10,17-22,27H2,1-4H3/t34-/m1/s1
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n/an/a 3.10n/an/an/an/a7.4n/a



LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD

US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM161513
PNG
(US9108983, Example 44)
Show SMILES Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2n(C)ccc2c1
Show InChI InChI=1S/C43H42N6O6/c1-27-35(43(52)49(31-8-10-34(50)11-9-31)32-19-29-12-13-45(2)41(29)44-23-32)20-38(46(27)3)36-21-39-40(55-26-54-39)22-37(36)42(51)48-24-30-7-5-4-6-28(30)18-33(48)25-47-14-16-53-17-15-47/h4-13,19-23,33,50H,14-18,24-26H2,1-3H3/t33-/m0/s1
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n/an/a 3n/an/an/an/a7.4n/a



LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD

US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...


US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair