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Patent code US10807988

Compile Data Set for Download or QSAR

Found 790 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
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM469670
PNG
(US10807988, Example SC_3305 | cis-8-[Methyl-(tetra...)
Show SMILES CN(CC1CCOC1)[C@]1(CC[C@]2(CN(C(=O)N2)c2cnc(nc2)N2CCOCC2)CC1)c1ccccc1
Show InChI InChI=1S/C28H38N6O3/c1-32(19-22-7-14-37-20-22)28(23-5-3-2-4-6-23)10-8-27(9-11-28)21-34(26(35)31-27)24-17-29-25(30-18-24)33-12-15-36-16-13-33/h2-6,17-18,22H,7-16,19-21H2,1H3,(H,31,35)/t22?,27-,28+
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US Patent


Assay Description
The hMOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl (pH 7.4)...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM469657
PNG
(US10807988, Example SC_3292 | cis-8-[Methyl-(tetra...)
Show SMILES CN(CC1CCOC1)[C@]1(CC[C@]2(CN(C(=O)N2)c2cnc(nc2)C(F)(F)F)CC1)c1ccccc1
Show InChI InChI=1S/C25H30F3N5O2/c1-32(15-18-7-12-35-16-18)24(19-5-3-2-4-6-19)10-8-23(9-11-24)17-33(22(34)31-23)20-13-29-21(30-14-20)25(26,27)28/h2-6,13-14,18H,7-12,15-17H2,1H3,(H,31,34)/t18?,23-,24+
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US Patent


Assay Description
The hMOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl (pH 7.4)...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469509
PNG
(US10807988, Example SC_3144 | trans-5-(8-Ethylamin...)
Show SMILES CCN[C@@]1(CC[C@]2(CN(C(=O)N2)c2cnc(nc2OC)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C22H26N6O2/c1-3-25-22(16-7-5-4-6-8-16)11-9-21(10-12-22)15-28(20(29)27-21)17-14-24-18(13-23)26-19(17)30-2/h4-8,14,25H,3,9-12,15H2,1-2H3,(H,27,29)/t21-,22-
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469582
PNG
(US10807988, Example SC_3215 | cis-8-Benzyl-8-dimet...)
Show SMILES CN(C)[C@@]1(Cc2ccccc2)CC[C@]2(CN(C(=O)N2)c2cnc(cc2C)C(F)(F)F)CC1
Show InChI InChI=1S/C24H29F3N4O/c1-17-13-20(24(25,26)27)28-15-19(17)31-16-22(29-21(31)32)9-11-23(12-10-22,30(2)3)14-18-7-5-4-6-8-18/h4-8,13,15H,9-12,14,16H2,1-3H3,(H,29,32)/t22-,23+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469491
PNG
(US10807988, Example SC_3128 | US10807988, Example ...)
Show SMILES CCN[C@]1(CC[C@]2(CN(C(=O)N2)c2ccccc2C#N)CC1)c1ccccc1
Show InChI InChI=1S/C23H26N4O/c1-2-25-23(19-9-4-3-5-10-19)14-12-22(13-15-23)17-27(21(28)26-22)20-11-7-6-8-18(20)16-24/h3-11,25H,2,12-15,17H2,1H3,(H,26,28)/t22-,23+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469489
PNG
(US10807988, Example SC_3126 | cis--2-(8-Ethylamino...)
Show SMILES CCN[C@]1(CC[C@]2(CN(C(=O)N2)c2ccccc2C(N)=O)CC1)c1ccccc1
Show InChI InChI=1S/C23H28N4O2/c1-2-25-23(17-8-4-3-5-9-17)14-12-22(13-15-23)16-27(21(29)26-22)19-11-7-6-10-18(19)20(24)28/h3-11,25H,2,12-16H2,1H3,(H2,24,28)(H,26,29)/t22-,23+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM469749
PNG
(US10807988, Example SC_3386 | cis-8-Dimethylamino-...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2)c2cnc(cc2C)C(F)(F)F)CC1)c1cc(C)cc(F)c1
Show InChI InChI=1S/C24H28F4N4O/c1-15-9-17(12-18(25)10-15)23(31(3)4)7-5-22(6-8-23)14-32(21(33)30-22)19-13-29-20(11-16(19)2)24(26,27)28/h9-13H,5-8,14H2,1-4H3,(H,30,33)/t22-,23+
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Assay Description
The hMOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl (pH 7.4)...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469490
PNG
(US10807988, Example SC_3127 | cis-2-(8-Ethylamino-...)
Show SMILES CCN[C@@]1(CC[C@]2(CN(C(=O)N2)c2ccccc2C#N)CC1)c1ccccc1
Show InChI InChI=1S/C23H26N4O/c1-2-25-23(19-9-4-3-5-10-19)14-12-22(13-15-23)17-27(21(28)26-22)20-11-7-6-8-18(20)16-24/h3-11,25H,2,12-15,17H2,1H3,(H,26,28)/t22-,23-
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469586
PNG
(US10807988, Example SC_3219 | cis-8-Dimethylamino-...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2)c2cnc(nc2)C(F)(F)F)CC1)c1nc2ccccc2n1C
Show InChI InChI=1S/C23H26F3N7O/c1-31(2)22(19-29-16-6-4-5-7-17(16)32(19)3)10-8-21(9-11-22)14-33(20(34)30-21)15-12-27-18(28-13-15)23(24,25)26/h4-7,12-13H,8-11,14H2,1-3H3,(H,30,34)/t21-,22+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM469489
PNG
(US10807988, Example SC_3126 | cis--2-(8-Ethylamino...)
Show SMILES CCN[C@]1(CC[C@]2(CN(C(=O)N2)c2ccccc2C(N)=O)CC1)c1ccccc1
Show InChI InChI=1S/C23H28N4O2/c1-2-25-23(17-8-4-3-5-9-17)14-12-22(13-15-23)16-27(21(29)26-22)19-11-7-6-10-18(19)20(24)28/h3-11,25H,2,12-16H2,1H3,(H2,24,28)(H,26,29)/t22-,23+
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Assay Description
The hMOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl (pH 7.4)...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469508
PNG
(US10807988, Example SC_3143 | cis-5-(8-Ethylamino-...)
Show SMILES CCN[C@]1(CC[C@]2(CN(C(=O)N2)c2cnc(nc2OC)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C22H26N6O2/c1-3-25-22(16-7-5-4-6-8-16)11-9-21(10-12-22)15-28(20(29)27-21)17-14-24-18(13-23)26-19(17)30-2/h4-8,14,25H,3,9-12,15H2,1-2H3,(H,27,29)/t21-,22+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM469658
PNG
(US10807988, Example SC_3293 | cis-8-[Methyl-(tetra...)
Show SMILES CN(CC1CCOC1)[C@]1(CC[C@]2(CN(C(=O)N2)c2cnc(nc2)C(F)(F)F)CC1)c1ccccc1
Show InChI InChI=1S/C25H30F3N5O2/c1-32(15-18-7-12-35-16-18)24(19-5-3-2-4-6-19)10-8-23(9-11-24)17-33(22(34)31-23)20-13-29-21(30-14-20)25(26,27)28/h2-6,13-14,18H,7-12,15-17H2,1H3,(H,31,34)/t18?,23-,24+
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Assay Description
The hMOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl (pH 7.4)...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469350
PNG
(US10807988, Example SC_3001 | cis-5-[1-(Cyclobutyl...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2cnc(nc2)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C26H32N6O/c1-30(2)26(21-9-4-3-5-10-21)13-11-25(12-14-26)19-31(22-16-28-23(15-27)29-17-22)24(33)32(25)18-20-7-6-8-20/h3-5,9-10,16-17,20H,6-8,11-14,18-19H2,1-2H3/t25-,26+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469352
PNG
(US10807988, Example SC_3003 | cis-5-[1-(Cyclobutyl...)
Show SMILES COc1nc(ncc1N1C[C@]2(CC[C@@](CC2)(N(C)C)c2ccccc2)N(CC2CCC2)C1=O)C#N
Show InChI InChI=1S/C27H34N6O2/c1-31(2)27(21-10-5-4-6-11-21)14-12-26(13-15-27)19-32(25(34)33(26)18-20-8-7-9-20)22-17-29-23(16-28)30-24(22)35-3/h4-6,10-11,17,20H,7-9,12-15,18-19H2,1-3H3/t26-,27+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469376
PNG
(US10807988, Example SC_3022 | cis-1-(Cyclobutyl-me...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2cnc(nc2)C(F)(F)F)CC1)c1ccccc1
Show InChI InChI=1S/C26H32F3N5O/c1-32(2)25(20-9-4-3-5-10-20)13-11-24(12-14-25)18-33(23(35)34(24)17-19-7-6-8-19)21-15-30-22(31-16-21)26(27,28)29/h3-5,9-10,15-16,19H,6-8,11-14,17-18H2,1-2H3/t24-,25+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469435
PNG
(US10807988, Example SC_3076 | cis-1-(Cyclobutyl-me...)
Show SMILES COc1ncc(cn1)N1C[C@]2(CC[C@@](CC2)(N(C)C)c2ccccc2)N(CC2CCC2)C1=O
Show InChI InChI=1S/C26H35N5O2/c1-29(2)26(21-10-5-4-6-11-21)14-12-25(13-15-26)19-30(22-16-27-23(33-3)28-17-22)24(32)31(25)18-20-8-7-9-20/h4-6,10-11,16-17,20H,7-9,12-15,18-19H2,1-3H3/t25-,26+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469382
PNG
(US10807988, Example SC_3028 | cis-4-[1-(Cyclobutyl...)
Show SMILES CN(C)C(=O)c1ccc(cc1)N1C[C@]2(CC[C@@](CC2)(N(C)C)c2ccccc2)N(CC2CCC2)C1=O
Show InChI InChI=1S/C30H40N4O2/c1-31(2)27(35)24-13-15-26(16-14-24)33-22-29(34(28(33)36)21-23-9-8-10-23)17-19-30(20-18-29,32(3)4)25-11-6-5-7-12-25/h5-7,11-16,23H,8-10,17-22H2,1-4H3/t29-,30+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469437
PNG
(US10807988, Example SC_3078 | cis-5-[1-(Cyclobutyl...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2cnc(cc2C)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C28H35N5O/c1-21-16-24(17-29)30-18-25(21)32-20-27(33(26(32)34)19-22-8-7-9-22)12-14-28(15-13-27,31(2)3)23-10-5-4-6-11-23/h4-6,10-11,16,18,22H,7-9,12-15,19-20H2,1-3H3/t27-,28+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469357
PNG
(US10807988, Example SC_3008 | cis-2-[1-(Cyclobutyl...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2ccc(cc2C#N)S(C)(=O)=O)CC1)c1ccccc1
Show InChI InChI=1S/C29H36N4O3S/c1-31(2)29(24-10-5-4-6-11-24)16-14-28(15-17-29)21-32(27(34)33(28)20-22-8-7-9-22)26-13-12-25(37(3,35)36)18-23(26)19-30/h4-6,10-13,18,22H,7-9,14-17,20-21H2,1-3H3/t28-,29+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469419
PNG
(US10807988, Example SC_3063 | cis-5-[1-[(1-Cyano-c...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2(CCC2)C#N)c2ccc(nc2)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C28H32N6O/c1-32(2)28(22-7-4-3-5-8-22)15-13-27(14-16-28)21-33(24-10-9-23(17-29)31-18-24)25(35)34(27)20-26(19-30)11-6-12-26/h3-5,7-10,18H,6,11-16,20-21H2,1-2H3/t27-,28+
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US Patent


Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469354
PNG
(US10807988, Example SC_3005 | cis-5-[1-(Cyclobutyl...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2cnc(nc2)C(N)=O)CC1)c1ccccc1
Show InChI InChI=1S/C26H34N6O2/c1-30(2)26(20-9-4-3-5-10-20)13-11-25(12-14-26)18-31(21-15-28-23(22(27)33)29-16-21)24(34)32(25)17-19-7-6-8-19/h3-5,9-10,15-16,19H,6-8,11-14,17-18H2,1-2H3,(H2,27,33)/t25-,26+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469365
PNG
(US10807988, Example SC_3014 | cis-2-[1-(Cyclobutyl...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2ncc(cn2)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C26H32N6O/c1-30(2)26(22-9-4-3-5-10-22)13-11-25(12-14-26)19-31(23-28-16-21(15-27)17-29-23)24(33)32(25)18-20-7-6-8-20/h3-5,9-10,16-17,20H,6-8,11-14,18-19H2,1-2H3/t25-,26+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469398
PNG
(US10807988, Example SC_3041 | cis-5-[1-[(1-Cyano-c...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2(CCC2)C#N)c2cnc(nc2)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C27H31N7O/c1-32(2)27(21-7-4-3-5-8-21)13-11-26(12-14-27)20-33(22-16-30-23(15-28)31-17-22)24(35)34(26)19-25(18-29)9-6-10-25/h3-5,7-8,16-17H,6,9-14,19-20H2,1-2H3/t26-,27+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469459
PNG
(US10807988, Example SC_3101 | cis-1-[(1-Hydroxy-cy...)
Show SMILES CN[C@]1(CC[C@]2(CN(C(=O)N2CC2(O)CCC2)c2cnc(nc2)N2CCN(C)CC2)CC1)c1ccccc1
Show InChI InChI=1S/C29H41N7O2/c1-30-29(23-7-4-3-5-8-23)13-11-27(12-14-29)21-35(26(37)36(27)22-28(38)9-6-10-28)24-19-31-25(32-20-24)34-17-15-33(2)16-18-34/h3-5,7-8,19-20,30,38H,6,9-18,21-22H2,1-2H3/t27-,29+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469405
PNG
(US10807988, Example SC_3048 | cis-4-[1-(Cyclobuty1...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2ccnc(n2)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C26H32N6O/c1-30(2)26(21-9-4-3-5-10-21)14-12-25(13-15-26)19-31(23-11-16-28-22(17-27)29-23)24(33)32(25)18-20-7-6-8-20/h3-5,9-11,16,20H,6-8,12-15,18-19H2,1-2H3/t25-,26+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469432
PNG
(US10807988, Example SC_3073 | cis-1-(Cyclobutyl-me...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2cnc(nc2)C(F)(F)F)CC1)c1ccccc1
Show InChI InChI=1S/C26H32F3N5O/c1-32(2)25(20-9-4-3-5-10-20)13-11-24(12-14-25)18-33(23(35)34(24)17-19-7-6-8-19)21-15-30-22(31-16-21)26(27,28)29/h3-5,9-10,15-16,19H,6-8,11-14,17-18H2,1-2H3/t24-,25+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469708
PNG
(US10807988, Example SC_3344 | cis-8-Dimethylamino-...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2)c2cnc(nc2)-c2cccc3C(=O)NCc23)CC1)c1ccccc1
Show InChI InChI=1S/C28H30N6O2/c1-33(2)28(19-7-4-3-5-8-19)13-11-27(12-14-28)18-34(26(36)32-27)20-15-29-24(30-16-20)21-9-6-10-22-23(21)17-31-25(22)35/h3-10,15-16H,11-14,17-18H2,1-2H3,(H,31,35)(H,32,36)/t27-,28+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM469458
PNG
(US10807988, Example SC_3100 | cis-8-Dimethylamino-...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2(O)CCC2)c2cnc(nc2)N2CCNCC2)CC1)c1ccccc1
Show InChI InChI=1S/C29H41N7O2/c1-33(2)29(23-7-4-3-5-8-23)13-11-27(12-14-29)21-35(26(37)36(27)22-28(38)9-6-10-28)24-19-31-25(32-20-24)34-17-15-30-16-18-34/h3-5,7-8,19-20,30,38H,6,9-18,21-22H2,1-2H3/t27-,29+
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Assay Description
The hMOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl (pH 7.4)...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM469461
PNG
(US10807988, Example SC_3103 | cis-1-(Cyclobutyl-me...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2cnc(cc2C)C(F)(F)F)CC1)c1ccccc1
Show InChI InChI=1S/C28H35F3N4O/c1-20-16-24(28(29,30)31)32-17-23(20)34-19-26(35(25(34)36)18-21-8-7-9-21)12-14-27(15-13-26,33(2)3)22-10-5-4-6-11-22/h4-6,10-11,16-17,21H,7-9,12-15,18-19H2,1-3H3/t26-,27+
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Assay Description
The hMOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl (pH 7.4)...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM469491
PNG
(US10807988, Example SC_3128 | US10807988, Example ...)
Show SMILES CCN[C@]1(CC[C@]2(CN(C(=O)N2)c2ccccc2C#N)CC1)c1ccccc1
Show InChI InChI=1S/C23H26N4O/c1-2-25-23(19-9-4-3-5-10-19)14-12-22(13-15-23)17-27(21(28)26-22)20-11-7-6-8-18(20)16-24/h3-11,25H,2,12-15,17H2,1H3,(H,26,28)/t22-,23+
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Assay Description
The hMOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl (pH 7.4)...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469764
PNG
(US10807988, Example SC_3401 | cis-1-(Cyclobutyl-me...)
Show SMILES CN[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2cnc(nc2)C(F)(F)F)CC1)c1cccc(F)c1
Show InChI InChI=1S/C25H29F4N5O/c1-30-24(18-6-3-7-19(26)12-18)10-8-23(9-11-24)16-33(22(35)34(23)15-17-4-2-5-17)20-13-31-21(32-14-20)25(27,28)29/h3,6-7,12-14,17,30H,2,4-5,8-11,15-16H2,1H3/t23-,24+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469378
PNG
(US10807988, Example SC_3024 | cis-5-[8-Dimethylami...)
Show SMILES CC(C)CN1C(=O)N(C[C@]11CC[C@@](CC1)(N(C)C)c1ccccc1)c1cnc(nc1)C#N
Show InChI InChI=1S/C25H32N6O/c1-19(2)17-31-23(32)30(21-15-27-22(14-26)28-16-21)18-24(31)10-12-25(13-11-24,29(3)4)20-8-6-5-7-9-20/h5-9,15-16,19H,10-13,17-18H2,1-4H3/t24-,25+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM469586
PNG
(US10807988, Example SC_3219 | cis-8-Dimethylamino-...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2)c2cnc(nc2)C(F)(F)F)CC1)c1nc2ccccc2n1C
Show InChI InChI=1S/C23H26F3N7O/c1-31(2)22(19-29-16-6-4-5-7-17(16)32(19)3)10-8-21(9-11-22)14-33(20(34)30-21)15-12-27-18(28-13-15)23(24,25)26/h4-7,12-13H,8-11,14H2,1-3H3,(H,30,34)/t21-,22+
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Assay Description
The hMOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl (pH 7.4)...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469395
PNG
(US10807988, Example SC_3038 | cis-1-(Cyclobutyl-me...)
Show SMILES CN[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2cnc(nc2)C(F)(F)F)CC1)c1ccccc1
Show InChI InChI=1S/C25H30F3N5O/c1-29-24(19-8-3-2-4-9-19)12-10-23(11-13-24)17-32(22(34)33(23)16-18-6-5-7-18)20-14-30-21(31-15-20)25(26,27)28/h2-4,8-9,14-15,18,29H,5-7,10-13,16-17H2,1H3/t23-,24+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM469460
PNG
(US10807988, Example SC_3102 | cis-1-[(1-Hydroxy-cy...)
Show SMILES CN[C@]1(CC[C@]2(CN(C(=O)N2CC2(O)CCC2)c2cnc(nc2)N2CCNCC2)CC1)c1ccccc1
Show InChI InChI=1S/C28H39N7O2/c1-29-28(22-6-3-2-4-7-22)12-10-26(11-13-28)20-34(25(36)35(26)21-27(37)8-5-9-27)23-18-31-24(32-19-23)33-16-14-30-15-17-33/h2-4,6-7,18-19,29-30,37H,5,8-17,20-21H2,1H3/t26-,28+
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Assay Description
The hMOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl (pH 7.4)...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM469498
PNG
(US10807988, Example SC_3135 | cis-4-(8-Ethylamino-...)
Show SMILES CCN[C@]1(CC[C@]2(CN(C(=O)N2)c2ccc(cc2OC)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C24H28N4O2/c1-3-26-24(19-7-5-4-6-8-19)13-11-23(12-14-24)17-28(22(29)27-23)20-10-9-18(16-25)15-21(20)30-2/h4-10,15,26H,3,11-14,17H2,1-2H3,(H,27,29)/t23-,24+
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Assay Description
The hMOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl (pH 7.4)...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469498
PNG
(US10807988, Example SC_3135 | cis-4-(8-Ethylamino-...)
Show SMILES CCN[C@]1(CC[C@]2(CN(C(=O)N2)c2ccc(cc2OC)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C24H28N4O2/c1-3-26-24(19-7-5-4-6-8-19)13-11-23(12-14-24)17-28(22(29)27-23)20-10-9-18(16-25)15-21(20)30-2/h4-10,15,26H,3,11-14,17H2,1-2H3,(H,27,29)/t23-,24+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469458
PNG
(US10807988, Example SC_3100 | cis-8-Dimethylamino-...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2(O)CCC2)c2cnc(nc2)N2CCNCC2)CC1)c1ccccc1
Show InChI InChI=1S/C29H41N7O2/c1-33(2)29(23-7-4-3-5-8-23)13-11-27(12-14-29)21-35(26(37)36(27)22-28(38)9-6-10-28)24-19-31-25(32-20-24)34-17-15-30-16-18-34/h3-5,7-8,19-20,30,38H,6,9-18,21-22H2,1-2H3/t27-,29+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469452
PNG
(US10807988, Example SC_3093 | cis-2-[1-(Cyclobutyl...)
Show SMILES COc1ccc(N2C[C@]3(CC[C@@](CC3)(N(C)C)c3ccccc3)N(CC3CCC3)C2=O)c(c1)C#N
Show InChI InChI=1S/C29H36N4O2/c1-31(2)29(24-10-5-4-6-11-24)16-14-28(15-17-29)21-32(27(34)33(28)20-22-8-7-9-22)26-13-12-25(35-3)18-23(26)19-30/h4-6,10-13,18,22H,7-9,14-17,20-21H2,1-3H3/t28-,29+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469445
PNG
(US10807988, Example SC_3086 | cis-1-(Cyclobutyl-me...)
Show SMILES COc1ccc(N2C[C@]3(CC[C@@](CC3)(N(C)C)c3ccccc3)N(CC3CCC3)C2=O)c(OC)c1
Show InChI InChI=1S/C29H39N3O3/c1-30(2)29(23-11-6-5-7-12-23)17-15-28(16-18-29)21-31(27(33)32(28)20-22-9-8-10-22)25-14-13-24(34-3)19-26(25)35-4/h5-7,11-14,19,22H,8-10,15-18,20-21H2,1-4H3/t28-,29+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469355
PNG
(US10807988, Example SC_3006 | cis-5-[1-(Cyclobutyl...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2cnc(nc2C#N)S(C)(=O)=O)CC1)c1ccccc1
Show InChI InChI=1S/C27H34N6O3S/c1-31(2)27(21-10-5-4-6-11-21)14-12-26(13-15-27)19-32(25(34)33(26)18-20-8-7-9-20)23-17-29-24(37(3,35)36)30-22(23)16-28/h4-6,10-11,17,20H,7-9,12-15,18-19H2,1-3H3/t26-,27+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469358
PNG
(US10807988, Example SC_3009 | cis-2-[1-(Cyclobutyl...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2ccccc2C(N)=O)CC1)c1ccccc1
Show InChI InChI=1S/C28H36N4O2/c1-30(2)28(22-11-4-3-5-12-22)17-15-27(16-18-28)20-31(24-14-7-6-13-23(24)25(29)33)26(34)32(27)19-21-9-8-10-21/h3-7,11-14,21H,8-10,15-20H2,1-2H3,(H2,29,33)/t27-,28+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469449
PNG
(US10807988, Example SC_3090 | cis-2-[1-(Cyclobutyl...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2ccccc2C#N)CC1)c1ccccc1
Show InChI InChI=1S/C28H34N4O/c1-30(2)28(24-12-4-3-5-13-24)17-15-27(16-18-28)21-31(25-14-7-6-11-23(25)19-29)26(33)32(27)20-22-9-8-10-22/h3-7,11-14,22H,8-10,15-18,20-21H2,1-2H3/t27-,28+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469351
PNG
(US10807988, Example SC_3002 | cis-5-[1-(Cyclobutyl...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2cnc(cn2)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C26H32N6O/c1-30(2)26(21-9-4-3-5-10-21)13-11-25(12-14-26)19-31(23-17-28-22(15-27)16-29-23)24(33)32(25)18-20-7-6-8-20/h3-5,9-10,16-17,20H,6-8,11-14,18-19H2,1-2H3/t25-,26+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469364
PNG
(US10807988, Example SC_3013 | cis-5-[8-Dimethylami...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2(O)CCC2)c2cnc(nc2)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C26H32N6O2/c1-30(2)26(20-7-4-3-5-8-20)13-11-24(12-14-26)18-31(21-16-28-22(15-27)29-17-21)23(33)32(24)19-25(34)9-6-10-25/h3-5,7-8,16-17,34H,6,9-14,18-19H2,1-2H3/t24-,26+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469392
PNG
(US10807988, Example SC_3036 | cis-5-[8-Dimethylami...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2(C)CCC2)c2cnc(nc2)C#N)CC1)c1ccccc1
Show InChI InChI=1S/C27H34N6O/c1-25(10-7-11-25)19-33-24(34)32(22-17-29-23(16-28)30-18-22)20-26(33)12-14-27(15-13-26,31(2)3)21-8-5-4-6-9-21/h4-6,8-9,17-18H,7,10-15,19-20H2,1-3H3/t26-,27+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469433
PNG
(US10807988, Example SC_3074 | cis-5-[1-(Cyclobutyl...)
Show SMILES COC(=O)c1cc(C)c(cn1)N1C[C@]2(CC[C@@](CC2)(N(C)C)c2ccccc2)N(CC2CCC2)C1=O
Show InChI InChI=1S/C29H38N4O3/c1-21-17-24(26(34)36-4)30-18-25(21)32-20-28(33(27(32)35)19-22-9-8-10-22)13-15-29(16-14-28,31(2)3)23-11-6-5-7-12-23/h5-7,11-12,17-18,22H,8-10,13-16,19-20H2,1-4H3/t28-,29+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469444
PNG
(US10807988, Example SC_3085 | cis-1-(Cyclobutyl-me...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2ccc(nc2)C(F)(F)F)CC1)c1ccccc1
Show InChI InChI=1S/C27H33F3N4O/c1-32(2)26(21-9-4-3-5-10-21)15-13-25(14-16-26)19-33(24(35)34(25)18-20-7-6-8-20)22-11-12-23(31-17-22)27(28,29)30/h3-5,9-12,17,20H,6-8,13-16,18-19H2,1-2H3/t25-,26+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469439
PNG
(US10807988, Example SC_3080 | cis-4-[1-(Cyclobutyl...)
Show SMILES COc1cc(ccc1N1C[C@]2(CC[C@@](CC2)(N(C)C)c2ccccc2)N(CC2CCC2)C1=O)C#N
Show InChI InChI=1S/C29H36N4O2/c1-31(2)29(24-10-5-4-6-11-24)16-14-28(15-17-29)21-32(27(34)33(28)20-22-8-7-9-22)25-13-12-23(19-30)18-26(25)35-3/h4-6,10-13,18,22H,7-9,14-17,20-21H2,1-3H3/t28-,29+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM469438
PNG
(US10807988, Example SC_3079 | cis-1-(Cyclobutyl-me...)
Show SMILES CN(C)[C@]1(CC[C@]2(CN(C(=O)N2CC2CCC2)c2ncc(F)cn2)CC1)c1ccccc1
Show InChI InChI=1S/C25H32FN5O/c1-29(2)25(20-9-4-3-5-10-20)13-11-24(12-14-25)18-30(22-27-15-21(26)16-28-22)23(32)31(24)17-19-7-6-8-19/h3-5,9-10,15-16,19H,6-8,11-14,17-18H2,1-2H3/t24-,25+
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Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...


US Patent US10807988 (2020)

More data for this
Ligand-Target Pair
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