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Patent code US9732061

Compile Data Set for Download or QSAR
Found 76 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
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334279
PNG
(US9732061, Compound 1)
Show SMILES OC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(CC3)S(=O)(=O)C(F)(F)F)c2c1
Show InChI InChI=1S/C27H23Cl2F3N4O3S/c28-20-6-1-17(2-7-20)26(37,18-3-8-21(29)9-4-18)19-5-10-24-23(15-19)25(16-33-35-24)34-22-11-13-36(14-12-22)40(38,39)27(30,31)32/h1-10,15-16,22,37H,11-14H2,(H,34,35)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334280
PNG
(US9732061, Compound 2)
Show SMILES CC(C)(C)OC(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C31H32Cl2N4O3/c1-30(2,3)40-29(38)37-16-14-25(15-17-37)35-28-19-34-36-27-13-8-22(18-26(27)28)31(39,20-4-9-23(32)10-5-20)21-6-11-24(33)12-7-21/h4-13,18-19,25,39H,14-17H2,1-3H3,(H,35,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334283
PNG
(US9732061, Compound 5)
Show SMILES FC(F)(F)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C27H23Cl2F3N4O2S/c28-20-6-1-17(2-7-20)26(18-3-8-21(29)9-4-18)19-5-10-24-23(15-19)25(16-33-35-24)34-22-11-13-36(14-12-22)39(37,38)27(30,31)32/h1-10,15-16,22,26H,11-14H2,(H,34,35)
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n/an/an/an/a 13n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334287
PNG
(US9732061, Compound 9)
Show SMILES FC(F)(F)c1ccc(CNc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C29H20Cl2F3N3/c30-23-10-3-19(4-11-23)28(20-5-12-24(31)13-6-20)21-7-14-26-25(15-21)27(17-36-37-26)35-16-18-1-8-22(9-2-18)29(32,33)34/h1-15,17,28H,16H2,(H,35,37)
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n/an/an/an/a 40n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334288
PNG
(US9732061, Compound 10)
Show SMILES OC(=O)c1ccc(cc1)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C33H28Cl2N4O4S/c34-25-8-1-21(2-9-25)32(22-3-10-26(35)11-4-22)24-7-14-30-29(19-24)31(20-36-38-30)37-27-15-17-39(18-16-27)44(42,43)28-12-5-23(6-13-28)33(40)41/h1-14,19-20,27,32H,15-18H2,(H,37,38)(H,40,41)
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n/an/an/an/a 1.48E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334291
PNG
(US9732061, Compound 13)
Show SMILES OC(=O)c1ccc(CN2CCC(CC2)Nc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C34H30Cl2N4O2/c35-27-10-5-23(6-11-27)33(24-7-12-28(36)13-8-24)26-9-14-31-30(19-26)32(20-37-39-31)38-29-15-17-40(18-16-29)21-22-1-3-25(4-2-22)34(41)42/h1-14,19-20,29,33H,15-18,21H2,(H,38,39)(H,41,42)
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n/an/an/an/a 1.44E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334312
PNG
(US9732061, Compound 34)
Show SMILES Fc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(CC3)S(=O)(=O)C(F)(F)F)c2c1
Show InChI InChI=1S/C27H23ClF4N4O2S/c28-20-6-1-17(2-7-20)26(18-3-8-21(29)9-4-18)19-5-10-24-23(15-19)25(16-33-35-24)34-22-11-13-36(14-12-22)39(37,38)27(30,31)32/h1-10,15-16,22,26H,11-14H2,(H,34,35)
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n/an/an/an/a 30n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334312
PNG
(US9732061, Compound 34)
Show SMILES Fc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(CC3)S(=O)(=O)C(F)(F)F)c2c1
Show InChI InChI=1S/C27H23ClF4N4O2S/c28-20-6-1-17(2-7-20)26(18-3-8-21(29)9-4-18)19-5-10-24-23(15-19)25(16-33-35-24)34-22-11-13-36(14-12-22)39(37,38)27(30,31)32/h1-10,15-16,22,26H,11-14H2,(H,34,35)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334313
PNG
(US9732061, Compound 35)
Show SMILES COc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(CC3)S(=O)(=O)C(F)(F)F)c2c1
Show InChI InChI=1S/C28H26ClF3N4O3S/c1-39-23-9-4-19(5-10-23)27(18-2-7-21(29)8-3-18)20-6-11-25-24(16-20)26(17-33-35-25)34-22-12-14-36(15-13-22)40(37,38)28(30,31)32/h2-11,16-17,22,27H,12-15H2,1H3,(H,34,35)
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n/an/an/an/a 11n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334286
PNG
(US9732061, Compound 8)
Show SMILES FC(F)(F)c1cccc(CNc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c1
Show InChI InChI=1S/C29H20Cl2F3N3/c30-23-9-4-19(5-10-23)28(20-6-11-24(31)12-7-20)21-8-13-26-25(15-21)27(17-36-37-26)35-16-18-2-1-3-22(14-18)29(32,33)34/h1-15,17,28H,16H2,(H,35,37)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334290
PNG
(US9732061, Compound 12)
Show SMILES OC(=O)c1cccc(CN2CCC(CC2)Nc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c1
Show InChI InChI=1S/C34H30Cl2N4O2/c35-27-9-4-23(5-10-27)33(24-6-11-28(36)12-7-24)25-8-13-31-30(19-25)32(20-37-39-31)38-29-14-16-40(17-15-29)21-22-2-1-3-26(18-22)34(41)42/h1-13,18-20,29,33H,14-17,21H2,(H,38,39)(H,41,42)
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n/an/an/an/a 302n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334290
PNG
(US9732061, Compound 12)
Show SMILES OC(=O)c1cccc(CN2CCC(CC2)Nc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c1
Show InChI InChI=1S/C34H30Cl2N4O2/c35-27-9-4-23(5-10-27)33(24-6-11-28(36)12-7-24)25-8-13-31-30(19-25)32(20-37-39-31)38-29-14-16-40(17-15-29)21-22-2-1-3-26(18-22)34(41)42/h1-13,18-20,29,33H,14-17,21H2,(H,38,39)(H,41,42)
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n/an/an/an/a 6.50E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334292
PNG
(US9732061, Compound 14)
Show SMILES OC(=O)c1ccc(o1)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C31H26Cl2N4O5S/c32-22-6-1-19(2-7-22)30(20-3-8-23(33)9-4-20)21-5-10-26-25(17-21)27(18-34-36-26)35-24-13-15-37(16-14-24)43(40,41)29-12-11-28(42-29)31(38)39/h1-12,17-18,24,30H,13-16H2,(H,35,36)(H,38,39)
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n/an/an/an/a 1.28E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334295
PNG
(US9732061, Compound 17)
Show SMILES OC(=O)c1ccc(cc1)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C33H28Cl2N4O2/c34-25-8-1-21(2-9-25)32(22-3-10-26(35)11-4-22)24-7-14-30-29(19-24)31(20-36-38-30)37-27-15-17-39(18-16-27)28-12-5-23(6-13-28)33(40)41/h1-14,19-20,27,32H,15-18H2,(H,37,38)(H,40,41)
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n/an/an/an/a 8.10E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334296
PNG
(US9732061, Compound 18)
Show SMILES OC(=O)c1ccccc1CN1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C34H30Cl2N4O2/c35-26-10-5-22(6-11-26)33(23-7-12-27(36)13-8-23)24-9-14-31-30(19-24)32(20-37-39-31)38-28-15-17-40(18-16-28)21-25-3-1-2-4-29(25)34(41)42/h1-14,19-20,28,33H,15-18,21H2,(H,38,39)(H,41,42)
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n/an/an/an/a 9.50E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334301
PNG
(US9732061, Compound 23)
Show SMILES OC(=O)c1cccc(CCN2CCC(CC2)Nc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c1
Show InChI InChI=1S/C35H32Cl2N4O2/c36-28-9-4-24(5-10-28)34(25-6-11-29(37)12-7-25)26-8-13-32-31(21-26)33(22-38-40-32)39-30-15-18-41(19-16-30)17-14-23-2-1-3-27(20-23)35(42)43/h1-13,20-22,30,34H,14-19H2,(H,39,40)(H,42,43)
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n/an/an/an/a 5.09E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334302
PNG
(US9732061, Compound 24)
Show SMILES FC(F)(F)S(=O)(=O)N1CCN(CC1)c1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C26H21Cl2F3N4O2S/c27-20-6-1-17(2-7-20)25(18-3-8-21(28)9-4-18)19-5-10-23-22(15-19)24(16-32-33-23)34-11-13-35(14-12-34)38(36,37)26(29,30)31/h1-10,15-16,25H,11-14H2
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334305
PNG
(US9732061, Compound 27)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(C3)S(=O)(=O)c3ccccc3)c2c1
Show InChI InChI=1S/C31H26Cl2N4O2S/c32-24-11-6-21(7-12-24)31(22-8-13-25(33)14-9-22)23-10-15-29-28(18-23)30(19-34-36-29)35-26-16-17-37(20-26)40(38,39)27-4-2-1-3-5-27/h1-15,18-19,26,31H,16-17,20H2,(H,35,36)
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n/an/an/an/a 272n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334308
PNG
(US9732061, Compound 30)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(CCc4ccccc4)CC3)c2c1
Show InChI InChI=1S/C34H32Cl2N4/c35-28-11-6-25(7-12-28)34(26-8-13-29(36)14-9-26)27-10-15-32-31(22-27)33(23-37-39-32)38-30-17-20-40(21-18-30)19-16-24-4-2-1-3-5-24/h1-15,22-23,30,34H,16-21H2,(H,38,39)
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n/an/an/an/a 643n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334309
PNG
(US9732061, Compound 31)
Show SMILES OC(=O)c1ccc(CCN2CCC(CC2)Nc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C35H32Cl2N4O2/c36-28-10-5-24(6-11-28)34(25-7-12-29(37)13-8-25)27-9-14-32-31(21-27)33(22-38-40-32)39-30-16-19-41(20-17-30)18-15-23-1-3-26(4-2-23)35(42)43/h1-14,21-22,30,34H,15-20H2,(H,39,40)(H,42,43)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334285
PNG
(US9732061, Compound 7)
Show SMILES OC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1ccc2nncc(NCc3ccc(cc3)C(F)(F)F)c2c1
Show InChI InChI=1S/C29H20Cl2F3N3O/c30-23-10-5-19(6-11-23)28(38,20-7-12-24(31)13-8-20)22-9-14-26-25(15-22)27(17-36-37-26)35-16-18-1-3-21(4-2-18)29(32,33)34/h1-15,17,38H,16H2,(H,35,37)
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n/an/an/an/a 219n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334287
PNG
(US9732061, Compound 9)
Show SMILES FC(F)(F)c1ccc(CNc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C29H20Cl2F3N3/c30-23-10-3-19(4-11-23)28(20-5-12-24(31)13-6-20)21-7-14-26-25(15-21)27(17-36-37-26)35-16-18-1-8-22(9-2-18)29(32,33)34/h1-15,17,28H,16H2,(H,35,37)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334288
PNG
(US9732061, Compound 10)
Show SMILES OC(=O)c1ccc(cc1)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C33H28Cl2N4O4S/c34-25-8-1-21(2-9-25)32(22-3-10-26(35)11-4-22)24-7-14-30-29(19-24)31(20-36-38-30)37-27-15-17-39(18-16-27)44(42,43)28-12-5-23(6-13-28)33(40)41/h1-14,19-20,27,32H,15-18H2,(H,37,38)(H,40,41)
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n/an/an/an/a 302n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334294
PNG
(US9732061, Compound 16)
Show SMILES OC(=O)c1ccc(s1)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C31H26Cl2N4O4S2/c32-22-6-1-19(2-7-22)30(20-3-8-23(33)9-4-20)21-5-10-26-25(17-21)27(18-34-36-26)35-24-13-15-37(16-14-24)43(40,41)29-12-11-28(42-29)31(38)39/h1-12,17-18,24,30H,13-16H2,(H,35,36)(H,38,39)
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n/an/an/an/a 262n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334306
PNG
(US9732061, Compound 28)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(Cc4ccccc4)C3)c2c1
Show InChI InChI=1S/C32H28Cl2N4/c33-26-11-6-23(7-12-26)32(24-8-13-27(34)14-9-24)25-10-15-30-29(18-25)31(19-35-37-30)36-28-16-17-38(21-28)20-22-4-2-1-3-5-22/h1-15,18-19,28,32H,16-17,20-21H2,(H,36,37)
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n/an/an/an/a 1.69E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334310
PNG
(US9732061, Compound 32)
Show SMILES OC(=O)c1csc(c1)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C31H26Cl2N4O4S2/c32-23-6-1-19(2-7-23)30(20-3-8-24(33)9-4-20)21-5-10-27-26(15-21)28(17-34-36-27)35-25-11-13-37(14-12-25)43(40,41)29-16-22(18-42-29)31(38)39/h1-10,15-18,25,30H,11-14H2,(H,35,36)(H,38,39)
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n/an/an/an/a 1.98E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334313
PNG
(US9732061, Compound 35)
Show SMILES COc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(CC3)S(=O)(=O)C(F)(F)F)c2c1
Show InChI InChI=1S/C28H26ClF3N4O3S/c1-39-23-9-4-19(5-10-23)27(18-2-7-21(29)8-3-18)20-6-11-25-24(16-20)26(17-33-35-25)34-22-12-14-36(15-13-22)40(37,38)28(30,31)32/h2-11,16-17,22,27H,12-15H2,1H3,(H,34,35)
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n/an/an/an/a 396n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334314
PNG
(US9732061, Compound 36)
Show SMILES FC(F)(F)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1nccs1)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H21ClF3N5O2S2/c25-17-4-1-15(2-5-17)22(23-29-9-12-36-23)16-3-6-20-19(13-16)21(14-30-32-20)31-18-7-10-33(11-8-18)37(34,35)24(26,27)28/h1-6,9,12-14,18,22H,7-8,10-11H2,(H,31,32)
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n/an/an/an/a 28n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334315
PNG
(US9732061, Compound 37)
Show SMILES OC(=O)c1ccc(CCNc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C30H23Cl2N3O2/c31-24-10-5-20(6-11-24)29(21-7-12-25(32)13-8-21)23-9-14-27-26(17-23)28(18-34-35-27)33-16-15-19-1-3-22(4-2-19)30(36)37/h1-14,17-18,29H,15-16H2,(H,33,35)(H,36,37)
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n/an/an/an/a 5.40E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334281
PNG
(US9732061, Compound 3)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(CC3)C(=O)c3ccccc3)c2c1
Show InChI InChI=1S/C33H28Cl2N4O/c34-26-11-6-22(7-12-26)32(23-8-13-27(35)14-9-23)25-10-15-30-29(20-25)31(21-36-38-30)37-28-16-18-39(19-17-28)33(40)24-4-2-1-3-5-24/h1-15,20-21,28,32H,16-19H2,(H,37,38)
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n/an/an/an/a 463n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334282
PNG
(US9732061, Compound 4)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(CC3)S(=O)(=O)c3ccccc3)c2c1
Show InChI InChI=1S/C32H28Cl2N4O2S/c33-25-11-6-22(7-12-25)32(23-8-13-26(34)14-9-23)24-10-15-30-29(20-24)31(21-35-37-30)36-27-16-18-38(19-17-27)41(39,40)28-4-2-1-3-5-28/h1-15,20-21,27,32H,16-19H2,(H,36,37)
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n/an/an/an/a 35n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334282
PNG
(US9732061, Compound 4)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(CC3)S(=O)(=O)c3ccccc3)c2c1
Show InChI InChI=1S/C32H28Cl2N4O2S/c33-25-11-6-22(7-12-25)32(23-8-13-26(34)14-9-23)24-10-15-30-29(20-24)31(21-35-37-30)36-27-16-18-38(19-17-27)41(39,40)28-4-2-1-3-5-28/h1-15,20-21,27,32H,16-19H2,(H,36,37)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334284
PNG
(US9732061, Compound 6)
Show SMILES OC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1ccc2nncc(NCc3cccc(c3)C(F)(F)F)c2c1
Show InChI InChI=1S/C29H20Cl2F3N3O/c30-23-9-4-19(5-10-23)28(38,20-6-11-24(31)12-7-20)21-8-13-26-25(15-21)27(17-36-37-26)35-16-18-2-1-3-22(14-18)29(32,33)34/h1-15,17,38H,16H2,(H,35,37)
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n/an/an/an/a 254n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334284
PNG
(US9732061, Compound 6)
Show SMILES OC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1ccc2nncc(NCc3cccc(c3)C(F)(F)F)c2c1
Show InChI InChI=1S/C29H20Cl2F3N3O/c30-23-9-4-19(5-10-23)28(38,20-6-11-24(31)12-7-20)21-8-13-26-25(15-21)27(17-36-37-26)35-16-18-2-1-3-22(14-18)29(32,33)34/h1-15,17,38H,16H2,(H,35,37)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334292
PNG
(US9732061, Compound 14)
Show SMILES OC(=O)c1ccc(o1)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C31H26Cl2N4O5S/c32-22-6-1-19(2-7-22)30(20-3-8-23(33)9-4-20)21-5-10-26-25(17-21)27(18-34-36-26)35-24-13-15-37(16-14-24)43(40,41)29-12-11-28(42-29)31(38)39/h1-12,17-18,24,30H,13-16H2,(H,35,36)(H,38,39)
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n/an/an/an/a 5.60E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334296
PNG
(US9732061, Compound 18)
Show SMILES OC(=O)c1ccccc1CN1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C34H30Cl2N4O2/c35-26-10-5-22(6-11-26)33(23-7-12-27(36)13-8-23)24-9-14-31-30(19-24)32(20-37-39-31)38-28-15-17-40(18-16-28)21-25-3-1-2-4-29(25)34(41)42/h1-14,19-20,28,33H,15-18,21H2,(H,38,39)(H,41,42)
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n/an/an/an/a 9.90E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334298
PNG
(US9732061, Compound 20)
Show SMILES COc1ccc(CNc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C29H23Cl2N3O/c1-35-25-13-2-19(3-14-25)17-32-28-18-33-34-27-15-8-22(16-26(27)28)29(20-4-9-23(30)10-5-20)21-6-11-24(31)12-7-21/h2-16,18,29H,17H2,1H3,(H,32,34)
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n/an/an/an/a 196n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334300
PNG
(US9732061, Compound 22)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(N3CCN(Cc4ccccc4)CC3)c2c1
Show InChI InChI=1S/C32H28Cl2N4/c33-27-11-6-24(7-12-27)32(25-8-13-28(34)14-9-25)26-10-15-30-29(20-26)31(21-35-36-30)38-18-16-37(17-19-38)22-23-4-2-1-3-5-23/h1-15,20-21,32H,16-19,22H2
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334305
PNG
(US9732061, Compound 27)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(C3)S(=O)(=O)c3ccccc3)c2c1
Show InChI InChI=1S/C31H26Cl2N4O2S/c32-24-11-6-21(7-12-24)31(22-8-13-25(33)14-9-22)23-10-15-29-28(18-23)30(19-34-36-29)35-26-16-17-37(20-26)40(38,39)27-4-2-1-3-5-27/h1-15,18-19,26,31H,16-17,20H2,(H,35,36)
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n/an/an/an/a 849n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334306
PNG
(US9732061, Compound 28)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(Cc4ccccc4)C3)c2c1
Show InChI InChI=1S/C32H28Cl2N4/c33-26-11-6-23(7-12-26)32(24-8-13-27(34)14-9-24)25-10-15-30-29(18-25)31(19-35-37-30)36-28-16-17-38(21-28)20-22-4-2-1-3-5-22/h1-15,18-19,28,32H,16-17,20-21H2,(H,36,37)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334309
PNG
(US9732061, Compound 31)
Show SMILES OC(=O)c1ccc(CCN2CCC(CC2)Nc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C35H32Cl2N4O2/c36-28-10-5-24(6-11-28)34(25-7-12-29(37)13-8-25)27-9-14-32-31(21-27)33(22-38-40-32)39-30-16-19-41(20-17-30)18-15-23-1-3-26(4-2-23)35(42)43/h1-14,21-22,30,34H,15-20H2,(H,39,40)(H,42,43)
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n/an/an/an/a 6.64E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334310
PNG
(US9732061, Compound 32)
Show SMILES OC(=O)c1csc(c1)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C31H26Cl2N4O4S2/c32-23-6-1-19(2-7-23)30(20-3-8-24(33)9-4-20)21-5-10-27-26(15-21)28(17-34-36-27)35-25-11-13-37(14-12-25)43(40,41)29-16-22(18-42-29)31(38)39/h1-10,15-18,25,30H,11-14H2,(H,35,36)(H,38,39)
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n/an/an/an/a 40n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334279
PNG
(US9732061, Compound 1)
Show SMILES OC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(CC3)S(=O)(=O)C(F)(F)F)c2c1
Show InChI InChI=1S/C27H23Cl2F3N4O3S/c28-20-6-1-17(2-7-20)26(37,18-3-8-21(29)9-4-18)19-5-10-24-23(15-19)25(16-33-35-24)34-22-11-13-36(14-12-22)40(38,39)27(30,31)32/h1-10,15-16,22,37H,11-14H2,(H,34,35)
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n/an/an/an/a 455n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334285
PNG
(US9732061, Compound 7)
Show SMILES OC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1ccc2nncc(NCc3ccc(cc3)C(F)(F)F)c2c1
Show InChI InChI=1S/C29H20Cl2F3N3O/c30-23-10-5-19(6-11-23)28(38,20-7-12-24(31)13-8-20)22-9-14-26-25(15-22)27(17-36-37-26)35-16-18-1-3-21(4-2-18)29(32,33)34/h1-15,17,38H,16H2,(H,35,37)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334294
PNG
(US9732061, Compound 16)
Show SMILES OC(=O)c1ccc(s1)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C31H26Cl2N4O4S2/c32-22-6-1-19(2-7-22)30(20-3-8-23(33)9-4-20)21-5-10-26-25(17-21)27(18-34-36-26)35-24-13-15-37(16-14-24)43(40,41)29-12-11-28(42-29)31(38)39/h1-12,17-18,24,30H,13-16H2,(H,35,36)(H,38,39)
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n/an/an/an/a 2.15E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334299
PNG
(US9732061, Compound 21)
Show SMILES Oc1ccc(CNc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C28H21Cl2N3O/c29-22-8-3-19(4-9-22)28(20-5-10-23(30)11-6-20)21-7-14-26-25(15-21)27(17-32-33-26)31-16-18-1-12-24(34)13-2-18/h1-15,17,28,34H,16H2,(H,31,33)
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n/an/an/an/a 5.93E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334301
PNG
(US9732061, Compound 23)
Show SMILES OC(=O)c1cccc(CCN2CCC(CC2)Nc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c1
Show InChI InChI=1S/C35H32Cl2N4O2/c36-28-9-4-24(5-10-28)34(25-6-11-29(37)12-7-25)26-8-13-32-31(21-26)33(22-38-40-32)39-30-15-18-41(19-16-30)17-14-23-2-1-3-27(20-23)35(42)43/h1-13,20-22,30,34H,14-19H2,(H,39,40)(H,42,43)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334302
PNG
(US9732061, Compound 24)
Show SMILES FC(F)(F)S(=O)(=O)N1CCN(CC1)c1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C26H21Cl2F3N4O2S/c27-20-6-1-17(2-7-20)25(18-3-8-21(28)9-4-18)19-5-10-23-22(15-19)24(16-32-33-23)34-11-13-35(14-12-34)38(36,37)26(29,30)31/h1-10,15-16,25H,11-14H2
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n/an/an/an/a 261n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334307
PNG
(US9732061, Compound 29)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(N3CCC(CC3)Nc3ccccc3)c2c1
Show InChI InChI=1S/C32H28Cl2N4/c33-25-11-6-22(7-12-25)32(23-8-13-26(34)14-9-23)24-10-15-30-29(20-24)31(21-35-37-30)38-18-16-28(17-19-38)36-27-4-2-1-3-5-27/h1-15,20-21,28,32,36H,16-19H2
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n/an/an/an/a 99n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334307
PNG
(US9732061, Compound 29)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(N3CCC(CC3)Nc3ccccc3)c2c1
Show InChI InChI=1S/C32H28Cl2N4/c33-25-11-6-22(7-12-25)32(23-8-13-26(34)14-9-23)24-10-15-30-29(20-24)31(21-35-37-30)38-18-16-28(17-19-38)36-27-4-2-1-3-5-27/h1-15,20-21,28,32,36H,16-19H2
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334311
PNG
(US9732061, Compound 33)
Show SMILES Fc1ccc(cc1)C(c1ccc(F)cc1)c1ccc2nncc(NC3CCN(CC3)S(=O)(=O)C(F)(F)F)c2c1
Show InChI InChI=1S/C27H23F5N4O2S/c28-20-6-1-17(2-7-20)26(18-3-8-21(29)9-4-18)19-5-10-24-23(15-19)25(16-33-35-24)34-22-11-13-36(14-12-22)39(37,38)27(30,31)32/h1-10,15-16,22,26H,11-14H2,(H,34,35)
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n/an/an/an/a 79n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334311
PNG
(US9732061, Compound 33)
Show SMILES Fc1ccc(cc1)C(c1ccc(F)cc1)c1ccc2nncc(NC3CCN(CC3)S(=O)(=O)C(F)(F)F)c2c1
Show InChI InChI=1S/C27H23F5N4O2S/c28-20-6-1-17(2-7-20)26(18-3-8-21(29)9-4-18)19-5-10-24-23(15-19)25(16-33-35-24)34-22-11-13-36(14-12-22)39(37,38)27(30,31)32/h1-10,15-16,22,26H,11-14H2,(H,34,35)
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n/an/an/an/a 4.70E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334316
PNG
(US9732061, Compound 38)
Show SMILES OC(=O)c1cccc(CCNc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c1
Show InChI InChI=1S/C30H23Cl2N3O2/c31-24-9-4-20(5-10-24)29(21-6-11-25(32)12-7-21)22-8-13-27-26(17-22)28(18-34-35-27)33-15-14-19-2-1-3-23(16-19)30(36)37/h1-13,16-18,29H,14-15H2,(H,33,35)(H,36,37)
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n/an/an/an/a 3.98E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334293
PNG
(US9732061, Compound 15)
Show SMILES OC(=O)c1ccc(CN2CCC(CC2)Nc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)s1
Show InChI InChI=1S/C32H28Cl2N4O2S/c33-23-6-1-20(2-7-23)31(21-3-8-24(34)9-4-21)22-5-11-28-27(17-22)29(18-35-37-28)36-25-13-15-38(16-14-25)19-26-10-12-30(41-26)32(39)40/h1-12,17-18,25,31H,13-16,19H2,(H,36,37)(H,39,40)
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n/an/an/an/a 3.69E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334298
PNG
(US9732061, Compound 20)
Show SMILES COc1ccc(CNc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C29H23Cl2N3O/c1-35-25-13-2-19(3-14-25)17-32-28-18-33-34-27-15-8-22(16-26(27)28)29(20-4-9-23(30)10-5-20)21-6-11-24(31)12-7-21/h2-16,18,29H,17H2,1H3,(H,32,34)
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n/an/an/an/a 3.58E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334303
PNG
(US9732061, Compound 25)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NCCc3ccccc3)c2c1
Show InChI InChI=1S/C29H23Cl2N3/c30-24-11-6-21(7-12-24)29(22-8-13-25(31)14-9-22)23-10-15-27-26(18-23)28(19-33-34-27)32-17-16-20-4-2-1-3-5-20/h1-15,18-19,29H,16-17H2,(H,32,34)
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n/an/an/an/a 35n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334303
PNG
(US9732061, Compound 25)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NCCc3ccccc3)c2c1
Show InChI InChI=1S/C29H23Cl2N3/c30-24-11-6-21(7-12-24)29(22-8-13-25(31)14-9-22)23-10-15-27-26(18-23)28(19-33-34-27)32-17-16-20-4-2-1-3-5-20/h1-15,18-19,29H,16-17H2,(H,32,34)
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n/an/an/an/a 2.47E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334304
PNG
(US9732061, Compound 26)
Show SMILES FC(F)(F)S(=O)(=O)N1CCC(C1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C26H21Cl2F3N4O2S/c27-19-6-1-16(2-7-19)25(17-3-8-20(28)9-4-17)18-5-10-23-22(13-18)24(14-32-34-23)33-21-11-12-35(15-21)38(36,37)26(29,30)31/h1-10,13-14,21,25H,11-12,15H2,(H,33,34)
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n/an/an/an/a 1.93E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334308
PNG
(US9732061, Compound 30)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(CCc4ccccc4)CC3)c2c1
Show InChI InChI=1S/C34H32Cl2N4/c35-28-11-6-25(7-12-28)34(26-8-13-29(36)14-9-26)27-10-15-32-31(22-27)33(23-37-39-32)38-30-17-20-40(21-18-30)19-16-24-4-2-1-3-5-24/h1-15,22-23,30,34H,16-21H2,(H,38,39)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334314
PNG
(US9732061, Compound 36)
Show SMILES FC(F)(F)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1nccs1)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H21ClF3N5O2S2/c25-17-4-1-15(2-5-17)22(23-29-9-12-36-23)16-3-6-20-19(13-16)21(14-30-32-20)31-18-7-10-33(11-8-18)37(34,35)24(26,27)28/h1-6,9,12-14,18,22H,7-8,10-11H2,(H,31,32)
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n/an/an/an/a 665n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334280
PNG
(US9732061, Compound 2)
Show SMILES CC(C)(C)OC(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C31H32Cl2N4O3/c1-30(2,3)40-29(38)37-16-14-25(15-17-37)35-28-19-34-36-27-13-8-22(18-26(27)28)31(39,20-4-9-23(32)10-5-20)21-6-11-24(33)12-7-21/h4-13,18-19,25,39H,14-17H2,1-3H3,(H,35,36)
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n/an/an/an/a 200n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334281
PNG
(US9732061, Compound 3)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(NC3CCN(CC3)C(=O)c3ccccc3)c2c1
Show InChI InChI=1S/C33H28Cl2N4O/c34-26-11-6-22(7-12-26)32(23-8-13-27(35)14-9-23)25-10-15-30-29(20-25)31(21-36-38-30)37-28-16-18-39(19-17-28)33(40)24-4-2-1-3-5-24/h1-15,20-21,28,32H,16-19H2,(H,37,38)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334283
PNG
(US9732061, Compound 5)
Show SMILES FC(F)(F)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C27H23Cl2F3N4O2S/c28-20-6-1-17(2-7-20)26(18-3-8-21(29)9-4-18)19-5-10-24-23(15-19)25(16-33-35-24)34-22-11-13-36(14-12-22)39(37,38)27(30,31)32/h1-10,15-16,22,26H,11-14H2,(H,34,35)
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n/an/an/an/a 3.35E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334286
PNG
(US9732061, Compound 8)
Show SMILES FC(F)(F)c1cccc(CNc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c1
Show InChI InChI=1S/C29H20Cl2F3N3/c30-23-9-4-19(5-10-23)28(20-6-11-24(31)12-7-20)21-8-13-26-25(15-21)27(17-36-37-26)35-16-18-2-1-3-22(14-18)29(32,33)34/h1-15,17,28H,16H2,(H,35,37)
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n/an/an/an/a 12n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334289
PNG
(US9732061, Compound 11)
Show SMILES OC(=O)c1cccc(c1)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C33H28Cl2N4O4S/c34-25-9-4-21(5-10-25)32(22-6-11-26(35)12-7-22)23-8-13-30-29(19-23)31(20-36-38-30)37-27-14-16-39(17-15-27)44(42,43)28-3-1-2-24(18-28)33(40)41/h1-13,18-20,27,32H,14-17H2,(H,37,38)(H,40,41)
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n/an/an/an/a 5.25E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334291
PNG
(US9732061, Compound 13)
Show SMILES OC(=O)c1ccc(CN2CCC(CC2)Nc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C34H30Cl2N4O2/c35-27-10-5-23(6-11-27)33(24-7-12-28(36)13-8-24)26-9-14-31-30(19-26)32(20-37-39-31)38-29-15-17-40(18-16-29)21-22-1-3-25(4-2-22)34(41)42/h1-14,19-20,29,33H,15-18,21H2,(H,38,39)(H,41,42)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334293
PNG
(US9732061, Compound 15)
Show SMILES OC(=O)c1ccc(CN2CCC(CC2)Nc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)s1
Show InChI InChI=1S/C32H28Cl2N4O2S/c33-23-6-1-20(2-7-23)31(21-3-8-24(34)9-4-21)22-5-11-28-27(17-22)29(18-35-37-28)36-25-13-15-38(16-14-25)19-26-10-12-30(41-26)32(39)40/h1-12,17-18,25,31H,13-16,19H2,(H,36,37)(H,39,40)
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n/an/an/an/a 399n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334295
PNG
(US9732061, Compound 17)
Show SMILES OC(=O)c1ccc(cc1)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C33H28Cl2N4O2/c34-25-8-1-21(2-9-25)32(22-3-10-26(35)11-4-22)24-7-14-30-29(19-24)31(20-36-38-30)37-27-15-17-39(18-16-27)28-12-5-23(6-13-28)33(40)41/h1-14,19-20,27,32H,15-18H2,(H,37,38)(H,40,41)
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n/an/an/an/a 1.01E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334297
PNG
(US9732061, Compound 19)
Show SMILES OC(=O)c1ccccc1S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C33H28Cl2N4O4S/c34-24-10-5-21(6-11-24)32(22-7-12-25(35)13-8-22)23-9-14-29-28(19-23)30(20-36-38-29)37-26-15-17-39(18-16-26)44(42,43)31-4-2-1-3-27(31)33(40)41/h1-14,19-20,26,32H,15-18H2,(H,37,38)(H,40,41)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334299
PNG
(US9732061, Compound 21)
Show SMILES Oc1ccc(CNc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C28H21Cl2N3O/c29-22-8-3-19(4-9-22)28(20-5-10-23(30)11-6-20)21-7-14-26-25(15-21)27(17-32-33-26)31-16-18-1-12-24(34)13-2-18/h1-15,17,28,34H,16H2,(H,31,33)
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n/an/an/an/a 1.16E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334300
PNG
(US9732061, Compound 22)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccc2nncc(N3CCN(Cc4ccccc4)CC3)c2c1
Show InChI InChI=1S/C32H28Cl2N4/c33-27-11-6-24(7-12-27)32(25-8-13-28(34)14-9-25)26-10-15-30-29(20-26)31(21-35-36-30)38-18-16-37(17-19-38)22-23-4-2-1-3-5-23/h1-15,20-21,32H,16-19,22H2
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n/an/an/an/a 6.55E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334304
PNG
(US9732061, Compound 26)
Show SMILES FC(F)(F)S(=O)(=O)N1CCC(C1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C26H21Cl2F3N4O2S/c27-19-6-1-16(2-7-19)25(17-3-8-20(28)9-4-17)18-5-10-23-22(13-18)24(14-32-34-23)33-21-11-12-35(15-21)38(36,37)26(29,30)31/h1-10,13-14,21,25H,11-12,15H2,(H,33,34)
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n/an/an/an/a 95n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor


(Homo sapiens (Human))
BDBM334315
PNG
(US9732061, Compound 37)
Show SMILES OC(=O)c1ccc(CCNc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C30H23Cl2N3O2/c31-24-10-5-20(6-11-24)29(21-7-12-25(32)13-8-21)23-9-14-27-26(17-23)28(18-34-35-27)33-16-15-19-1-3-22(4-2-19)30(36)37/h1-14,17-18,29H,15-16H2,(H,33,35)(H,36,37)
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n/an/an/an/a 2.79E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334316
PNG
(US9732061, Compound 38)
Show SMILES OC(=O)c1cccc(CCNc2cnnc3ccc(cc23)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c1
Show InChI InChI=1S/C30H23Cl2N3O2/c31-24-9-4-20(5-10-24)29(21-6-11-25(32)12-7-21)22-8-13-27-26(17-22)28(18-34-35-27)33-15-14-19-2-1-3-23(16-19)30(36)37/h1-13,16-18,29H,14-15H2,(H,33,35)(H,36,37)
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n/an/an/an/a 4.51E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334289
PNG
(US9732061, Compound 11)
Show SMILES OC(=O)c1cccc(c1)S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C33H28Cl2N4O4S/c34-25-9-4-21(5-10-25)32(22-6-11-26(35)12-7-22)23-8-13-30-29(19-23)31(20-36-38-30)37-27-14-16-39(17-15-27)44(42,43)28-3-1-2-24(18-28)33(40)41/h1-13,18-20,27,32H,14-17H2,(H,37,38)(H,40,41)
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n/an/an/an/a 181n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM334297
PNG
(US9732061, Compound 19)
Show SMILES OC(=O)c1ccccc1S(=O)(=O)N1CCC(CC1)Nc1cnnc2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C33H28Cl2N4O4S/c34-24-10-5-21(6-11-24)32(22-7-12-25(35)13-8-22)23-9-14-29-28(19-23)30(20-36-38-29)37-26-15-17-39(18-16-26)44(42,43)31-4-2-1-3-27(31)33(40)41/h1-14,19-20,26,32H,15-18H2,(H,37,38)(H,40,41)
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n/an/an/an/a 5.94E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The following mixtures and buffer solutions were prepared: (a) Buffer 1: HBSS (Mediatech Cat#21-023-CV) with 5 mM HEPES (1 mM stock, Gibco BRL Cat#15...


US Patent US9732061 (2017)

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