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Patent code US10214524

Compile Data Set for Download or QSAR
Found 20 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
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165927
PNG
(US10214524, Example 75 | US9067931, 75)
Show SMILES OC(=O)c1cccc(c1)-c1cccc2cc(sc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C23H22N2O3S/c26-22(24-19-13-25-9-7-14(19)8-10-25)20-12-16-4-2-6-18(21(16)29-20)15-3-1-5-17(11-15)23(27)28/h1-6,11-12,14,19H,7-10,13H2,(H,24,26)(H,27,28)/t19-/m0/s1
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<0.100n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165926
PNG
(US10214524, Example 73 | US9067931, 73)
Show SMILES NCc1ccccc1-c1cccc2cc(sc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C23H25N3OS/c24-13-17-4-1-2-6-18(17)19-7-3-5-16-12-21(28-22(16)19)23(27)25-20-14-26-10-8-15(20)9-11-26/h1-7,12,15,20H,8-11,13-14,24H2,(H,25,27)/t20-/m0/s1
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<1n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165925
PNG
(US10214524, Example 20 | US9067931, 20)
Show SMILES OCc1ccc(cc1)-c1cccc2cc(sc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C23H24N2O2S/c26-14-15-4-6-16(7-5-15)19-3-1-2-18-12-21(28-22(18)19)23(27)24-20-13-25-10-8-17(20)9-11-25/h1-7,12,17,20,26H,8-11,13-14H2,(H,24,27)/t20-/m0/s1
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1.60n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165935
PNG
(US10214524, Example 154 | US9067931, 154)
Show SMILES O=C(N[C@H]1CN2CCC1CC2)c1cc2cccc(-c3cccc(c3)C(=O)NC3CC3)c2o1
Show InChI InChI=1S/C26H27N3O3/c30-25(27-20-7-8-20)19-5-1-3-17(13-19)21-6-2-4-18-14-23(32-24(18)21)26(31)28-22-15-29-11-9-16(22)10-12-29/h1-6,13-14,16,20,22H,7-12,15H2,(H,27,30)(H,28,31)/t22-/m0/s1
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3n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165928
PNG
(US10214524, Example 76 | US9067931, 76)
Show SMILES CNC(=O)NCc1ccccc1-c1cccc2cc(sc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C25H28N4O2S/c1-26-25(31)27-14-18-5-2-3-7-19(18)20-8-4-6-17-13-22(32-23(17)20)24(30)28-21-15-29-11-9-16(21)10-12-29/h2-8,13,16,21H,9-12,14-15H2,1H3,(H,28,30)(H2,26,27,31)/t21-/m0/s1
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3.30n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165937
PNG
(US10214524, Example 175 | US9067931, 175)
Show SMILES CNC(=O)NCc1ccccc1-c1cccc2cc(oc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C25H28N4O3/c1-26-25(31)27-14-18-5-2-3-7-19(18)20-8-4-6-17-13-22(32-23(17)20)24(30)28-21-15-29-11-9-16(21)10-12-29/h2-8,13,16,21H,9-12,14-15H2,1H3,(H,28,30)(H2,26,27,31)/t21-/m0/s1
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8.30n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165936
PNG
(US10214524, Example 163 | US9067931, 163)
Show SMILES CN1CCN(CC1)C(=O)c1cccc(c1)-c1cccc2cc(oc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C28H32N4O3/c1-30-12-14-32(15-13-30)28(34)22-6-2-4-20(16-22)23-7-3-5-21-17-25(35-26(21)23)27(33)29-24-18-31-10-8-19(24)9-11-31/h2-7,16-17,19,24H,8-15,18H2,1H3,(H,29,33)/t24-/m0/s1
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14n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165929
PNG
(US10214524, Example 90 | US9067931, 90)
Show SMILES O=C(N[C@H]1CN2CCC1CC2)c1cc2cccc(-c3ccc(cc3)N3CCOCC3=O)c2o1
Show InChI InChI=1S/C26H27N3O4/c30-24-16-32-13-12-29(24)20-6-4-17(5-7-20)21-3-1-2-19-14-23(33-25(19)21)26(31)27-22-15-28-10-8-18(22)9-11-28/h1-7,14,18,22H,8-13,15-16H2,(H,27,31)/t22-/m0/s1
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14n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165930
PNG
(US10214524, Example 108 | US9067931, 108)
Show SMILES CCNC(=O)Nc1cccc(c1)-c1cccc2cc(oc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C25H28N4O3/c1-2-26-25(31)27-19-7-3-5-17(13-19)20-8-4-6-18-14-22(32-23(18)20)24(30)28-21-15-29-11-9-16(21)10-12-29/h3-8,13-14,16,21H,2,9-12,15H2,1H3,(H,28,30)(H2,26,27,31)/t21-/m0/s1
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17n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165931
PNG
(US10214524, Example 116 | US9067931, 116)
Show SMILES O=C(Nc1cccc(c1)-c1cccc2cc(oc12)C(=O)N[C@H]1CN2CCC1CC2)C1CC1
Show InChI InChI=1S/C26H27N3O3/c30-25(17-7-8-17)27-20-5-1-3-18(13-20)21-6-2-4-19-14-23(32-24(19)21)26(31)28-22-15-29-11-9-16(22)10-12-29/h1-6,13-14,16-17,22H,7-12,15H2,(H,27,30)(H,28,31)/t22-/m0/s1
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17n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165923
PNG
(US10214524, Example 17 | US9067931, 17)
Show SMILES COc1cccc(c1)-c1cccc2cc(sc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C23H24N2O2S/c1-27-18-6-2-4-16(12-18)19-7-3-5-17-13-21(28-22(17)19)23(26)24-20-14-25-10-8-15(20)9-11-25/h2-7,12-13,15,20H,8-11,14H2,1H3,(H,24,26)/t20-/m0/s1
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17n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165924
PNG
(US10214524, Example 19 | US9067931, 19)
Show SMILES O=C(N[C@H]1CN2CCC1CC2)c1cc2cccc(-c3ccc(cc3)N3CCOCC3)c2s1
Show InChI InChI=1S/C26H29N3O2S/c30-26(27-23-17-28-10-8-19(23)9-11-28)24-16-20-2-1-3-22(25(20)32-24)18-4-6-21(7-5-18)29-12-14-31-15-13-29/h1-7,16,19,23H,8-15,17H2,(H,27,30)/t23-/m0/s1
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20n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165922
PNG
(US10214524, Example 4 | US9067931, 4)
Show SMILES O=C(N[C@H]1CN2CCC1CC2)c1cc2ccc(cc2o1)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C26H29N3O3/c30-26(27-23-17-28-9-7-19(23)8-10-28)25-16-21-2-1-20(15-24(21)32-25)18-3-5-22(6-4-18)29-11-13-31-14-12-29/h1-6,15-16,19,23H,7-14,17H2,(H,27,30)/t23-/m0/s1
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24n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM50393246
PNG
(CHEMBL2151440 | US10214524, Example 130 | US906793...)
Show SMILES COc1ccccc1-c1cccc2cc(oc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C23H24N2O3/c1-27-20-8-3-2-6-17(20)18-7-4-5-16-13-21(28-22(16)18)23(26)24-19-14-25-11-9-15(19)10-12-25/h2-8,13,15,19H,9-12,14H2,1H3,(H,24,26)/t19-/m0/s1
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26n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165933
PNG
(US10214524, Example 150 | US9067931, 150)
Show SMILES OCc1ccccc1-c1cccc2cc(oc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C23H24N2O3/c26-14-17-4-1-2-6-18(17)19-7-3-5-16-12-21(28-22(16)19)23(27)24-20-13-25-10-8-15(20)9-11-25/h1-7,12,15,20,26H,8-11,13-14H2,(H,24,27)/t20-/m0/s1
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35n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165921
PNG
(US10214524, Example 3 | US9067931, 3)
Show SMILES OCc1ccc(cc1)-c1ccc2cc(oc2c1)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C23H24N2O3/c26-14-15-1-3-16(4-2-15)18-5-6-19-12-22(28-21(19)11-18)23(27)24-20-13-25-9-7-17(20)8-10-25/h1-6,11-12,17,20,26H,7-10,13-14H2,(H,24,27)/t20-/m0/s1
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60n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM50393246
PNG
(CHEMBL2151440 | US10214524, Example 130 | US906793...)
Show SMILES COc1ccccc1-c1cccc2cc(oc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C23H24N2O3/c1-27-20-8-3-2-6-17(20)18-7-4-5-16-13-21(28-22(16)18)23(26)24-19-14-25-11-9-15(19)10-12-25/h2-8,13,15,19H,9-12,14H2,1H3,(H,24,26)/t19-/m0/s1
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62n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165934
PNG
(US10214524, Example 151 | US9067931, 151)
Show SMILES COc1ccc(OC)c(c1)-c1cccc2cc(oc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C24H26N2O4/c1-28-17-6-7-21(29-2)19(13-17)18-5-3-4-16-12-22(30-23(16)18)24(27)25-20-14-26-10-8-15(20)9-11-26/h3-7,12-13,15,20H,8-11,14H2,1-2H3,(H,25,27)/t20-/m0/s1
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88n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165932
PNG
(US10214524, Example 149 | US9067931, 149)
Show SMILES OC(=O)c1cccc(c1)-c1cccc2cc(oc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C23H22N2O4/c26-22(24-19-13-25-9-7-14(19)8-10-25)20-12-16-4-2-6-18(21(16)29-20)15-3-1-5-17(11-15)23(27)28/h1-6,11-12,14,19H,7-10,13H2,(H,24,26)(H,27,28)/t19-/m0/s1
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97n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM165938
PNG
(US10214524, Example 186 | US9067931, 186)
Show SMILES Oc1ccccc1-c1cccc2cc(oc12)C(=O)N[C@H]1CN2CCC1CC2
Show InChI InChI=1S/C22H22N2O3/c25-19-7-2-1-5-16(19)17-6-3-4-15-12-20(27-21(15)17)22(26)23-18-13-24-10-8-14(18)9-11-24/h1-7,12,14,18,25H,8-11,13H2,(H,23,26)/t18-/m0/s1
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US Patent
120n/an/an/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

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Assay Description
Rat brain tissue (hippocampus or whole brain) is homogenized in homogenization buffer (10% w/v, 0.32 M sucrose, 1 mM EDTA, 0.1 mM phenylmethylsulphon...


US Patent US10214524 (2019)

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Ligand-Target Pair
* indicates data uncertainty>20%