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PubMed code 15163178

Compile data set for download or QSAR
Found 70 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
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147740
PNG
(1-(1-Cyclooctyl-piperidin-4-yl)-1,3-dihydro-indol-...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCCCCCC1
Show InChI InChI=1S/C21H30N2O/c24-21-16-17-8-6-7-11-20(17)23(21)19-12-14-22(15-13-19)18-9-4-2-1-3-5-10-18/h6-8,11,18-19H,1-5,9-10,12-16H2
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1.40n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147743
PNG
(1-(1-Bicyclo[3.3.1]non-9-yl-piperidin-4-yl)-1,3-di...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1C2CCCC1CCC2 |THB:13:16:19.18.20:23.24.22|
Show InChI InChI=1S/C22H30N2O/c25-21-15-18-5-1-2-10-20(18)24(21)19-11-13-23(14-12-19)22-16-6-3-7-17(22)9-4-8-16/h1-2,5,10,16-17,19,22H,3-4,6-9,11-15H2
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2.70n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147735
PNG
(1-[1-(4-Isopropyl-cyclohexyl)-piperidin-4-yl]-1,3-...)
Show SMILES CC(C)[C@H]1CC[C@H](CC1)N1CCC(CC1)N1C(=O)Cc2ccccc12 |wD:6.9,3.2,(24.86,-7.21,;24.05,-5.88,;24.8,-4.53,;22.51,-5.93,;21.72,-4.6,;20.17,-4.65,;19.43,-6,;20.25,-7.31,;21.78,-7.28,;17.91,-6.04,;17.1,-4.72,;15.55,-4.77,;14.83,-6.12,;15.63,-7.44,;17.17,-7.39,;13.29,-6.16,;12.34,-4.95,;12.78,-3.47,;10.9,-5.46,;10.94,-7,;9.85,-8.05,;10.21,-9.57,;11.69,-9.99,;12.8,-8.93,;12.43,-7.42,)|
Show InChI InChI=1S/C22H32N2O/c1-16(2)17-7-9-19(10-8-17)23-13-11-20(12-14-23)24-21-6-4-3-5-18(21)15-22(24)25/h3-6,16-17,19-20H,7-15H2,1-2H3/t17-,19+
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4n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147742
PNG
(1-[(R)-1-(Decahydro-naphthalen-2-yl)-piperidin-4-y...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCC2CCCC[C@@H]2C1
Show InChI InChI=1S/C23H32N2O/c26-23-16-19-7-3-4-8-22(19)25(23)20-11-13-24(14-12-20)21-10-9-17-5-1-2-6-18(17)15-21/h3-4,7-8,17-18,20-21H,1-2,5-6,9-16H2/t17?,18-,21?/m1/s1
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4.70n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147750
PNG
(1-[1-(Decahydro-naphthalen-2-yl)-piperidin-4-yl]-1...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCC2CCCCC2C1
Show InChI InChI=1S/C23H32N2O/c26-23-16-19-7-3-4-8-22(19)25(23)20-11-13-24(14-12-20)21-10-9-17-5-1-2-6-18(17)15-21/h3-4,7-8,17-18,20-21H,1-2,5-6,9-16H2
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5.60n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147749
PNG
(1-(1-Cyclooctylmethyl-piperidin-4-yl)-1,3-dihydro-...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC2CCCCCCC2)CC1
Show InChI InChI=1S/C22H32N2O/c25-22-16-19-10-6-7-11-21(19)24(22)20-12-14-23(15-13-20)17-18-8-4-2-1-3-5-9-18/h6-7,10-11,18,20H,1-5,8-9,12-17H2
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6n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147743
PNG
(1-(1-Bicyclo[3.3.1]non-9-yl-piperidin-4-yl)-1,3-di...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1C2CCCC1CCC2 |THB:13:16:19.18.20:23.24.22|
Show InChI InChI=1S/C22H30N2O/c25-21-15-18-5-1-2-10-20(18)24(21)19-11-13-23(14-12-19)22-16-6-3-7-17(22)9-4-8-16/h1-2,5,10,16-17,19,22H,3-4,6-9,11-15H2
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7.5n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147735
PNG
(1-[1-(4-Isopropyl-cyclohexyl)-piperidin-4-yl]-1,3-...)
Show SMILES CC(C)[C@H]1CC[C@H](CC1)N1CCC(CC1)N1C(=O)Cc2ccccc12 |wD:6.9,3.2,(24.86,-7.21,;24.05,-5.88,;24.8,-4.53,;22.51,-5.93,;21.72,-4.6,;20.17,-4.65,;19.43,-6,;20.25,-7.31,;21.78,-7.28,;17.91,-6.04,;17.1,-4.72,;15.55,-4.77,;14.83,-6.12,;15.63,-7.44,;17.17,-7.39,;13.29,-6.16,;12.34,-4.95,;12.78,-3.47,;10.9,-5.46,;10.94,-7,;9.85,-8.05,;10.21,-9.57,;11.69,-9.99,;12.8,-8.93,;12.43,-7.42,)|
Show InChI InChI=1S/C22H32N2O/c1-16(2)17-7-9-19(10-8-17)23-13-11-20(12-14-23)24-21-6-4-3-5-18(21)15-22(24)25/h3-6,16-17,19-20H,7-15H2,1-2H3/t17-,19+
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8n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147750
PNG
(1-[1-(Decahydro-naphthalen-2-yl)-piperidin-4-yl]-1...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCC2CCCCC2C1
Show InChI InChI=1S/C23H32N2O/c26-23-16-19-7-3-4-8-22(19)25(23)20-11-13-24(14-12-20)21-10-9-17-5-1-2-6-18(17)15-21/h3-4,7-8,17-18,20-21H,1-2,5-6,9-16H2
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11n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147741
PNG
(1-[1-(1,2,3,4-Tetrahydro-naphthalen-1-yl)-piperidi...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCCc2ccccc12
Show InChI InChI=1S/C23H26N2O/c26-23-16-18-7-2-4-10-21(18)25(23)19-12-14-24(15-13-19)22-11-5-8-17-6-1-3-9-20(17)22/h1-4,6-7,9-10,19,22H,5,8,11-16H2
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12n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147749
PNG
(1-(1-Cyclooctylmethyl-piperidin-4-yl)-1,3-dihydro-...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC2CCCCCCC2)CC1
Show InChI InChI=1S/C22H32N2O/c25-22-16-19-10-6-7-11-21(19)24(22)20-12-14-23(15-13-20)17-18-8-4-2-1-3-5-9-18/h6-7,10-11,18,20H,1-5,8-9,12-17H2
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14n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147739
PNG
(1-[1-(6,6-Dimethyl-bicyclo[3.1.1]hept-2-ylmethyl)-...)
Show SMILES CC1(C)C2CC1C(CN1CCC(CC1)N1C(=O)Cc3ccccc13)CC2 |THB:7:6:1:4|
Show InChI InChI=1S/C23H32N2O/c1-23(2)18-8-7-17(20(23)14-18)15-24-11-9-19(10-12-24)25-21-6-4-3-5-16(21)13-22(25)26/h3-6,17-20H,7-15H2,1-2H3
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16n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147742
PNG
(1-[(R)-1-(Decahydro-naphthalen-2-yl)-piperidin-4-y...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCC2CCCC[C@@H]2C1
Show InChI InChI=1S/C23H32N2O/c26-23-16-19-7-3-4-8-22(19)25(23)20-11-13-24(14-12-20)21-10-9-17-5-1-2-6-18(17)15-21/h3-4,7-8,17-18,20-21H,1-2,5-6,9-16H2/t17?,18-,21?/m1/s1
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16n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147747
PNG
(1-[1-(Decahydro-naphthalen-1-yl)-piperidin-4-yl]-1...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCCC2CCCCC12
Show InChI InChI=1S/C23H32N2O/c26-23-16-18-7-2-4-10-21(18)25(23)19-12-14-24(15-13-19)22-11-5-8-17-6-1-3-9-20(17)22/h2,4,7,10,17,19-20,22H,1,3,5-6,8-9,11-16H2
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16n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147748
PNG
(1-{1-[1-(9H-Fluoren-2-yl)-ethyl]-piperidin-4-yl}-1...)
Show SMILES CC(N1CCC(CC1)N1C(=O)Cc2ccccc12)c1ccc-2c(Cc3ccccc-23)c1
Show InChI InChI=1S/C28H28N2O/c1-19(20-10-11-26-23(16-20)17-21-6-2-4-8-25(21)26)29-14-12-24(13-15-29)30-27-9-5-3-7-22(27)18-28(30)31/h2-11,16,19,24H,12-15,17-18H2,1H3
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20n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147741
PNG
(1-[1-(1,2,3,4-Tetrahydro-naphthalen-1-yl)-piperidi...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCCc2ccccc12
Show InChI InChI=1S/C23H26N2O/c26-23-16-18-7-2-4-10-21(18)25(23)19-12-14-24(15-13-19)22-11-5-8-17-6-1-3-9-20(17)22/h1-4,6-7,9-10,19,22H,5,8,11-16H2
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21n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147741
PNG
(1-[1-(1,2,3,4-Tetrahydro-naphthalen-1-yl)-piperidi...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCCc2ccccc12
Show InChI InChI=1S/C23H26N2O/c26-23-16-18-7-2-4-10-21(18)25(23)19-12-14-24(15-13-19)22-11-5-8-17-6-1-3-9-20(17)22/h1-4,6-7,9-10,19,22H,5,8,11-16H2
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22n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50409823
PNG
(CHEMBL2112407)
Show SMILES O=C1Cc2ccccc2N1C1CCN(C[C@H]2CC3CCC2C3)CC1 |r,THB:14:15:21:19.18|
Show InChI InChI=1S/C21H28N2O/c24-21-13-17-3-1-2-4-20(17)23(21)19-7-9-22(10-8-19)14-18-12-15-5-6-16(18)11-15/h1-4,15-16,18-19H,5-14H2/t15?,16?,18-/m1/s1
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22n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147745
PNG
(1-[1-(4-Isopropyl-cyclohexyl)-piperidin-4-yl]-1,3-...)
Show SMILES CC(C)[C@H]1CC[C@@H](CC1)N1CCC(CC1)N1C(=O)Cc2ccccc12 |wU:3.2,wD:6.9,(24.92,-3.48,;24.12,-2.15,;24.85,-.8,;22.58,-2.2,;21.84,-3.55,;20.3,-3.58,;19.5,-2.27,;20.23,-.92,;21.77,-.87,;17.97,-2.31,;17.15,-.99,;15.61,-1.03,;14.89,-2.39,;15.7,-3.71,;17.22,-3.66,;13.35,-2.43,;12.41,-1.22,;12.84,.26,;10.96,-1.73,;11.01,-3.27,;9.9,-4.34,;10.27,-5.84,;11.74,-6.26,;12.86,-5.2,;12.49,-3.69,)|
Show InChI InChI=1S/C22H32N2O/c1-16(2)17-7-9-19(10-8-17)23-13-11-20(12-14-23)24-21-6-4-3-5-18(21)15-22(24)25/h3-6,16-17,19-20H,7-15H2,1-2H3/t17-,19-
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22n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147739
PNG
(1-[1-(6,6-Dimethyl-bicyclo[3.1.1]hept-2-ylmethyl)-...)
Show SMILES CC1(C)C2CC1C(CN1CCC(CC1)N1C(=O)Cc3ccccc13)CC2 |THB:7:6:1:4|
Show InChI InChI=1S/C23H32N2O/c1-23(2)18-8-7-17(20(23)14-18)15-24-11-9-19(10-12-24)25-21-6-4-3-5-16(21)13-22(25)26/h3-6,17-20H,7-15H2,1-2H3
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28n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50409822
PNG
(CHEMBL2111608)
Show SMILES O=C1Cc2ccccc2N1C1CCN(C[C@@H]2CC3CCC2C3)CC1 |r,THB:14:15:21:19.18|
Show InChI InChI=1S/C21H28N2O/c24-21-13-17-3-1-2-4-20(17)23(21)19-7-9-22(10-8-19)14-18-12-15-5-6-16(18)11-15/h1-4,15-16,18-19H,5-14H2/t15?,16?,18-/m0/s1
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28n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147738
PNG
(1-[1-(1,2,3,4-Tetrahydro-naphthalen-2-yl)-piperidi...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCc2ccccc2C1
Show InChI InChI=1S/C23H26N2O/c26-23-16-19-7-3-4-8-22(19)25(23)20-11-13-24(14-12-20)21-10-9-17-5-1-2-6-18(17)15-21/h1-8,20-21H,9-16H2
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29n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147740
PNG
(1-(1-Cyclooctyl-piperidin-4-yl)-1,3-dihydro-indol-...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCCCCCC1
Show InChI InChI=1S/C21H30N2O/c24-21-16-17-8-6-7-11-20(17)23(21)19-12-14-22(15-13-19)18-9-4-2-1-3-5-10-18/h6-8,11,18-19H,1-5,9-10,12-16H2
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30n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147743
PNG
(1-(1-Bicyclo[3.3.1]non-9-yl-piperidin-4-yl)-1,3-di...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1C2CCCC1CCC2 |THB:13:16:19.18.20:23.24.22|
Show InChI InChI=1S/C22H30N2O/c25-21-15-18-5-1-2-10-20(18)24(21)19-11-13-23(14-12-19)22-16-6-3-7-17(22)9-4-8-16/h1-2,5,10,16-17,19,22H,3-4,6-9,11-15H2
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32n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147747
PNG
(1-[1-(Decahydro-naphthalen-1-yl)-piperidin-4-yl]-1...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCCC2CCCCC12
Show InChI InChI=1S/C23H32N2O/c26-23-16-18-7-2-4-10-21(18)25(23)19-12-14-24(15-13-19)22-11-5-8-17-6-1-3-9-20(17)22/h2,4,7,10,17,19-20,22H,1,3,5-6,8-9,11-16H2
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37n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147738
PNG
(1-[1-(1,2,3,4-Tetrahydro-naphthalen-2-yl)-piperidi...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCc2ccccc2C1
Show InChI InChI=1S/C23H26N2O/c26-23-16-19-7-3-4-8-22(19)25(23)20-11-13-24(14-12-20)21-10-9-17-5-1-2-6-18(17)15-21/h1-8,20-21H,9-16H2
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39n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147740
PNG
(1-(1-Cyclooctyl-piperidin-4-yl)-1,3-dihydro-indol-...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCCCCCC1
Show InChI InChI=1S/C21H30N2O/c24-21-16-17-8-6-7-11-20(17)23(21)19-12-14-22(15-13-19)18-9-4-2-1-3-5-10-18/h6-8,11,18-19H,1-5,9-10,12-16H2
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43n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147750
PNG
(1-[1-(Decahydro-naphthalen-2-yl)-piperidin-4-yl]-1...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCC2CCCCC2C1
Show InChI InChI=1S/C23H32N2O/c26-23-16-19-7-3-4-8-22(19)25(23)20-11-13-24(14-12-20)21-10-9-17-5-1-2-6-18(17)15-21/h3-4,7-8,17-18,20-21H,1-2,5-6,9-16H2
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52n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147738
PNG
(1-[1-(1,2,3,4-Tetrahydro-naphthalen-2-yl)-piperidi...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCc2ccccc2C1
Show InChI InChI=1S/C23H26N2O/c26-23-16-19-7-3-4-8-22(19)25(23)20-11-13-24(14-12-20)21-10-9-17-5-1-2-6-18(17)15-21/h1-8,20-21H,9-16H2
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55n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147745
PNG
(1-[1-(4-Isopropyl-cyclohexyl)-piperidin-4-yl]-1,3-...)
Show SMILES CC(C)[C@H]1CC[C@@H](CC1)N1CCC(CC1)N1C(=O)Cc2ccccc12 |wU:3.2,wD:6.9,(24.92,-3.48,;24.12,-2.15,;24.85,-.8,;22.58,-2.2,;21.84,-3.55,;20.3,-3.58,;19.5,-2.27,;20.23,-.92,;21.77,-.87,;17.97,-2.31,;17.15,-.99,;15.61,-1.03,;14.89,-2.39,;15.7,-3.71,;17.22,-3.66,;13.35,-2.43,;12.41,-1.22,;12.84,.26,;10.96,-1.73,;11.01,-3.27,;9.9,-4.34,;10.27,-5.84,;11.74,-6.26,;12.86,-5.2,;12.49,-3.69,)|
Show InChI InChI=1S/C22H32N2O/c1-16(2)17-7-9-19(10-8-17)23-13-11-20(12-14-23)24-21-6-4-3-5-18(21)15-22(24)25/h3-6,16-17,19-20H,7-15H2,1-2H3/t17-,19-
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71n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147748
PNG
(1-{1-[1-(9H-Fluoren-2-yl)-ethyl]-piperidin-4-yl}-1...)
Show SMILES CC(N1CCC(CC1)N1C(=O)Cc2ccccc12)c1ccc-2c(Cc3ccccc-23)c1
Show InChI InChI=1S/C28H28N2O/c1-19(20-10-11-26-23(16-20)17-21-6-2-4-8-25(21)26)29-14-12-24(13-15-29)30-27-9-5-3-7-22(27)18-28(30)31/h2-11,16,19,24H,12-15,17-18H2,1H3
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74n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147746
PNG
(1-(1-Benzyl-piperidin-4-yl)-1,3-dihydro-indol-2-on...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C20H22N2O/c23-20-14-17-8-4-5-9-19(17)22(20)18-10-12-21(13-11-18)15-16-6-2-1-3-7-16/h1-9,18H,10-15H2
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85n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147746
PNG
(1-(1-Benzyl-piperidin-4-yl)-1,3-dihydro-indol-2-on...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C20H22N2O/c23-20-14-17-8-4-5-9-19(17)22(20)18-10-12-21(13-11-18)15-16-6-2-1-3-7-16/h1-9,18H,10-15H2
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91n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50409823
PNG
(CHEMBL2112407)
Show SMILES O=C1Cc2ccccc2N1C1CCN(C[C@H]2CC3CCC2C3)CC1 |r,THB:14:15:21:19.18|
Show InChI InChI=1S/C21H28N2O/c24-21-13-17-3-1-2-4-20(17)23(21)19-7-9-22(10-8-19)14-18-12-15-5-6-16(18)11-15/h1-4,15-16,18-19H,5-14H2/t15?,16?,18-/m1/s1
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115n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50409822
PNG
(CHEMBL2111608)
Show SMILES O=C1Cc2ccccc2N1C1CCN(C[C@@H]2CC3CCC2C3)CC1 |r,THB:14:15:21:19.18|
Show InChI InChI=1S/C21H28N2O/c24-21-13-17-3-1-2-4-20(17)23(21)19-7-9-22(10-8-19)14-18-12-15-5-6-16(18)11-15/h1-4,15-16,18-19H,5-14H2/t15?,16?,18-/m0/s1
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118n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147748
PNG
(1-{1-[1-(9H-Fluoren-2-yl)-ethyl]-piperidin-4-yl}-1...)
Show SMILES CC(N1CCC(CC1)N1C(=O)Cc2ccccc12)c1ccc-2c(Cc3ccccc-23)c1
Show InChI InChI=1S/C28H28N2O/c1-19(20-10-11-26-23(16-20)17-21-6-2-4-8-25(21)26)29-14-12-24(13-15-29)30-27-9-5-3-7-22(27)18-28(30)31/h2-11,16,19,24H,12-15,17-18H2,1H3
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135n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147742
PNG
(1-[(R)-1-(Decahydro-naphthalen-2-yl)-piperidin-4-y...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCC2CCCC[C@@H]2C1
Show InChI InChI=1S/C23H32N2O/c26-23-16-19-7-3-4-8-22(19)25(23)20-11-13-24(14-12-20)21-10-9-17-5-1-2-6-18(17)15-21/h3-4,7-8,17-18,20-21H,1-2,5-6,9-16H2/t17?,18-,21?/m1/s1
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137n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147735
PNG
(1-[1-(4-Isopropyl-cyclohexyl)-piperidin-4-yl]-1,3-...)
Show SMILES CC(C)[C@H]1CC[C@H](CC1)N1CCC(CC1)N1C(=O)Cc2ccccc12 |wD:6.9,3.2,(24.86,-7.21,;24.05,-5.88,;24.8,-4.53,;22.51,-5.93,;21.72,-4.6,;20.17,-4.65,;19.43,-6,;20.25,-7.31,;21.78,-7.28,;17.91,-6.04,;17.1,-4.72,;15.55,-4.77,;14.83,-6.12,;15.63,-7.44,;17.17,-7.39,;13.29,-6.16,;12.34,-4.95,;12.78,-3.47,;10.9,-5.46,;10.94,-7,;9.85,-8.05,;10.21,-9.57,;11.69,-9.99,;12.8,-8.93,;12.43,-7.42,)|
Show InChI InChI=1S/C22H32N2O/c1-16(2)17-7-9-19(10-8-17)23-13-11-20(12-14-23)24-21-6-4-3-5-18(21)15-22(24)25/h3-6,16-17,19-20H,7-15H2,1-2H3/t17-,19+
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148n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147739
PNG
(1-[1-(6,6-Dimethyl-bicyclo[3.1.1]hept-2-ylmethyl)-...)
Show SMILES CC1(C)C2CC1C(CN1CCC(CC1)N1C(=O)Cc3ccccc13)CC2 |THB:7:6:1:4|
Show InChI InChI=1S/C23H32N2O/c1-23(2)18-8-7-17(20(23)14-18)15-24-11-9-19(10-12-24)25-21-6-4-3-5-16(21)13-22(25)26/h3-6,17-20H,7-15H2,1-2H3
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175n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147746
PNG
(1-(1-Benzyl-piperidin-4-yl)-1,3-dihydro-indol-2-on...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C20H22N2O/c23-20-14-17-8-4-5-9-19(17)22(20)18-10-12-21(13-11-18)15-16-6-2-1-3-7-16/h1-9,18H,10-15H2
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201n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147747
PNG
(1-[1-(Decahydro-naphthalen-1-yl)-piperidin-4-yl]-1...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCCC2CCCCC12
Show InChI InChI=1S/C23H32N2O/c26-23-16-18-7-2-4-10-21(18)25(23)19-12-14-24(15-13-19)22-11-5-8-17-6-1-3-9-20(17)22/h2,4,7,10,17,19-20,22H,1,3,5-6,8-9,11-16H2
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202n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147744
PNG
(1-{1-[1-(4-Cyclohexyl-phenyl)-ethyl]-piperidin-4-y...)
Show SMILES CC(N1CCC(CC1)N1C(=O)Cc2ccccc12)c1ccc(cc1)C1CCCCC1
Show InChI InChI=1S/C27H34N2O/c1-20(21-11-13-23(14-12-21)22-7-3-2-4-8-22)28-17-15-25(16-18-28)29-26-10-6-5-9-24(26)19-27(29)30/h5-6,9-14,20,22,25H,2-4,7-8,15-19H2,1H3
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210n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50147737
PNG
(1-(1-Dicyclohexylmethyl-piperidin-4-yl)-1,3-dihydr...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C(C1CCCCC1)C1CCCCC1
Show InChI InChI=1S/C26H38N2O/c29-25-19-22-13-7-8-14-24(22)28(25)23-15-17-27(18-16-23)26(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h7-8,13-14,20-21,23,26H,1-6,9-12,15-19H2
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227n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor mu 1 on CHO cell membranes was determined by [3H]DAMGO displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147749
PNG
(1-(1-Cyclooctylmethyl-piperidin-4-yl)-1,3-dihydro-...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC2CCCCCCC2)CC1
Show InChI InChI=1S/C22H32N2O/c25-22-16-19-10-6-7-11-21(19)24(22)20-12-14-23(15-13-20)17-18-8-4-2-1-3-5-9-18/h6-7,10-11,18,20H,1-5,8-9,12-17H2
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229n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147744
PNG
(1-{1-[1-(4-Cyclohexyl-phenyl)-ethyl]-piperidin-4-y...)
Show SMILES CC(N1CCC(CC1)N1C(=O)Cc2ccccc12)c1ccc(cc1)C1CCCCC1
Show InChI InChI=1S/C27H34N2O/c1-20(21-11-13-23(14-12-21)22-7-3-2-4-8-22)28-17-15-25(16-18-28)29-26-10-6-5-9-24(26)19-27(29)30/h5-6,9-14,20,22,25H,2-4,7-8,15-19H2,1H3
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253n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50409822
PNG
(CHEMBL2111608)
Show SMILES O=C1Cc2ccccc2N1C1CCN(C[C@@H]2CC3CCC2C3)CC1 |r,THB:14:15:21:19.18|
Show InChI InChI=1S/C21H28N2O/c24-21-13-17-3-1-2-4-20(17)23(21)19-7-9-22(10-8-19)14-18-12-15-5-6-16(18)11-15/h1-4,15-16,18-19H,5-14H2/t15?,16?,18-/m0/s1
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318n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147737
PNG
(1-(1-Dicyclohexylmethyl-piperidin-4-yl)-1,3-dihydr...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C(C1CCCCC1)C1CCCCC1
Show InChI InChI=1S/C26H38N2O/c29-25-19-22-13-7-8-14-24(22)28(25)23-15-17-27(18-16-23)26(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h7-8,13-14,20-21,23,26H,1-6,9-12,15-19H2
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343n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147745
PNG
(1-[1-(4-Isopropyl-cyclohexyl)-piperidin-4-yl]-1,3-...)
Show SMILES CC(C)[C@H]1CC[C@@H](CC1)N1CCC(CC1)N1C(=O)Cc2ccccc12 |wU:3.2,wD:6.9,(24.92,-3.48,;24.12,-2.15,;24.85,-.8,;22.58,-2.2,;21.84,-3.55,;20.3,-3.58,;19.5,-2.27,;20.23,-.92,;21.77,-.87,;17.97,-2.31,;17.15,-.99,;15.61,-1.03,;14.89,-2.39,;15.7,-3.71,;17.22,-3.66,;13.35,-2.43,;12.41,-1.22,;12.84,.26,;10.96,-1.73,;11.01,-3.27,;9.9,-4.34,;10.27,-5.84,;11.74,-6.26,;12.86,-5.2,;12.49,-3.69,)|
Show InChI InChI=1S/C22H32N2O/c1-16(2)17-7-9-19(10-8-17)23-13-11-20(12-14-23)24-21-6-4-3-5-18(21)15-22(24)25/h3-6,16-17,19-20H,7-15H2,1-2H3/t17-,19-
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369n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50409823
PNG
(CHEMBL2112407)
Show SMILES O=C1Cc2ccccc2N1C1CCN(C[C@H]2CC3CCC2C3)CC1 |r,THB:14:15:21:19.18|
Show InChI InChI=1S/C21H28N2O/c24-21-13-17-3-1-2-4-20(17)23(21)19-7-9-22(10-8-19)14-18-12-15-5-6-16(18)11-15/h1-4,15-16,18-19H,5-14H2/t15?,16?,18-/m1/s1
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372n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50147744
PNG
(1-{1-[1-(4-Cyclohexyl-phenyl)-ethyl]-piperidin-4-y...)
Show SMILES CC(N1CCC(CC1)N1C(=O)Cc2ccccc12)c1ccc(cc1)C1CCCCC1
Show InChI InChI=1S/C27H34N2O/c1-20(21-11-13-23(14-12-21)22-7-3-2-4-8-22)28-17-15-25(16-18-28)29-26-10-6-5-9-24(26)19-27(29)30/h5-6,9-14,20,22,25H,2-4,7-8,15-19H2,1H3
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3.87E+3n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Opioid receptor kappa 1 on CHO cell membranes by [3H]U-69593 displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147737
PNG
(1-(1-Dicyclohexylmethyl-piperidin-4-yl)-1,3-dihydr...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C(C1CCCCC1)C1CCCCC1
Show InChI InChI=1S/C26H38N2O/c29-25-19-22-13-7-8-14-24(22)28(25)23-15-17-27(18-16-23)26(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h7-8,13-14,20-21,23,26H,1-6,9-12,15-19H2
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>1.00E+4n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50409822
PNG
(CHEMBL2111608)
Show SMILES O=C1Cc2ccccc2N1C1CCN(C[C@@H]2CC3CCC2C3)CC1 |r,THB:14:15:21:19.18|
Show InChI InChI=1S/C21H28N2O/c24-21-13-17-3-1-2-4-20(17)23(21)19-7-9-22(10-8-19)14-18-12-15-5-6-16(18)11-15/h1-4,15-16,18-19H,5-14H2/t15?,16?,18-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 transfected on CHO cells was determined using [3H]Cl-DPDPE


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50409823
PNG
(CHEMBL2112407)
Show SMILES O=C1Cc2ccccc2N1C1CCN(C[C@H]2CC3CCC2C3)CC1 |r,THB:14:15:21:19.18|
Show InChI InChI=1S/C21H28N2O/c24-21-13-17-3-1-2-4-20(17)23(21)19-7-9-22(10-8-19)14-18-12-15-5-6-16(18)11-15/h1-4,15-16,18-19H,5-14H2/t15?,16?,18-/m1/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 transfected on CHO cells was determined using [3H]Cl-DPDPE


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50147743
PNG
(1-(1-Bicyclo[3.3.1]non-9-yl-piperidin-4-yl)-1,3-di...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1C2CCCC1CCC2 |THB:13:16:19.18.20:23.24.22|
Show InChI InChI=1S/C22H30N2O/c25-21-15-18-5-1-2-10-20(18)24(21)19-11-13-23(14-12-19)22-16-6-3-7-17(22)9-4-8-16/h1-2,5,10,16-17,19,22H,3-4,6-9,11-15H2
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>1.00E+4n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 transfected on CHO cells was determined using [3H]Cl-DPDPE


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50147749
PNG
(1-(1-Cyclooctylmethyl-piperidin-4-yl)-1,3-dihydro-...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC2CCCCCCC2)CC1
Show InChI InChI=1S/C22H32N2O/c25-22-16-19-10-6-7-11-21(19)24(22)20-12-14-23(15-13-20)17-18-8-4-2-1-3-5-9-18/h6-7,10-11,18,20H,1-5,8-9,12-17H2
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>1.00E+4n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 transfected on CHO cells was determined using [3H]Cl-DPDPE


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147746
PNG
(1-(1-Benzyl-piperidin-4-yl)-1,3-dihydro-indol-2-on...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C20H22N2O/c23-20-14-17-8-4-5-9-19(17)22(20)18-10-12-21(13-11-18)15-16-6-2-1-3-7-16/h1-9,18H,10-15H2
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n/an/an/an/a 174n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50409823
PNG
(CHEMBL2112407)
Show SMILES O=C1Cc2ccccc2N1C1CCN(C[C@H]2CC3CCC2C3)CC1 |r,THB:14:15:21:19.18|
Show InChI InChI=1S/C21H28N2O/c24-21-13-17-3-1-2-4-20(17)23(21)19-7-9-22(10-8-19)14-18-12-15-5-6-16(18)11-15/h1-4,15-16,18-19H,5-14H2/t15?,16?,18-/m1/s1
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n/an/an/an/a>1.00E+4n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147742
PNG
(1-[(R)-1-(Decahydro-naphthalen-2-yl)-piperidin-4-y...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCC2CCCC[C@@H]2C1
Show InChI InChI=1S/C23H32N2O/c26-23-16-19-7-3-4-8-22(19)25(23)20-11-13-24(14-12-20)21-10-9-17-5-1-2-6-18(17)15-21/h3-4,7-8,17-18,20-21H,1-2,5-6,9-16H2/t17?,18-,21?/m1/s1
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n/an/an/an/a 75n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147739
PNG
(1-[1-(6,6-Dimethyl-bicyclo[3.1.1]hept-2-ylmethyl)-...)
Show SMILES CC1(C)C2CC1C(CN1CCC(CC1)N1C(=O)Cc3ccccc13)CC2 |THB:7:6:1:4|
Show InChI InChI=1S/C23H32N2O/c1-23(2)18-8-7-17(20(23)14-18)15-24-11-9-19(10-12-24)25-21-6-4-3-5-16(21)13-22(25)26/h3-6,17-20H,7-15H2,1-2H3
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n/an/an/an/a>1.00E+4n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147738
PNG
(1-[1-(1,2,3,4-Tetrahydro-naphthalen-2-yl)-piperidi...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCc2ccccc2C1
Show InChI InChI=1S/C23H26N2O/c26-23-16-19-7-3-4-8-22(19)25(23)20-11-13-24(14-12-20)21-10-9-17-5-1-2-6-18(17)15-21/h1-8,20-21H,9-16H2
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n/an/an/an/a 93n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147743
PNG
(1-(1-Bicyclo[3.3.1]non-9-yl-piperidin-4-yl)-1,3-di...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1C2CCCC1CCC2 |THB:13:16:19.18.20:23.24.22|
Show InChI InChI=1S/C22H30N2O/c25-21-15-18-5-1-2-10-20(18)24(21)19-11-13-23(14-12-19)22-16-6-3-7-17(22)9-4-8-16/h1-2,5,10,16-17,19,22H,3-4,6-9,11-15H2
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n/an/an/an/a 29n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50409822
PNG
(CHEMBL2111608)
Show SMILES O=C1Cc2ccccc2N1C1CCN(C[C@@H]2CC3CCC2C3)CC1 |r,THB:14:15:21:19.18|
Show InChI InChI=1S/C21H28N2O/c24-21-13-17-3-1-2-4-20(17)23(21)19-7-9-22(10-8-19)14-18-12-15-5-6-16(18)11-15/h1-4,15-16,18-19H,5-14H2/t15?,16?,18-/m0/s1
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n/an/an/an/a>1.00E+4n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147747
PNG
(1-[1-(Decahydro-naphthalen-1-yl)-piperidin-4-yl]-1...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCCC2CCCCC12
Show InChI InChI=1S/C23H32N2O/c26-23-16-18-7-2-4-10-21(18)25(23)19-12-14-24(15-13-19)22-11-5-8-17-6-1-3-9-20(17)22/h2,4,7,10,17,19-20,22H,1,3,5-6,8-9,11-16H2
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n/an/an/an/a 117n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147745
PNG
(1-[1-(4-Isopropyl-cyclohexyl)-piperidin-4-yl]-1,3-...)
Show SMILES CC(C)[C@H]1CC[C@@H](CC1)N1CCC(CC1)N1C(=O)Cc2ccccc12 |wU:3.2,wD:6.9,(24.92,-3.48,;24.12,-2.15,;24.85,-.8,;22.58,-2.2,;21.84,-3.55,;20.3,-3.58,;19.5,-2.27,;20.23,-.92,;21.77,-.87,;17.97,-2.31,;17.15,-.99,;15.61,-1.03,;14.89,-2.39,;15.7,-3.71,;17.22,-3.66,;13.35,-2.43,;12.41,-1.22,;12.84,.26,;10.96,-1.73,;11.01,-3.27,;9.9,-4.34,;10.27,-5.84,;11.74,-6.26,;12.86,-5.2,;12.49,-3.69,)|
Show InChI InChI=1S/C22H32N2O/c1-16(2)17-7-9-19(10-8-17)23-13-11-20(12-14-23)24-21-6-4-3-5-18(21)15-22(24)25/h3-6,16-17,19-20H,7-15H2,1-2H3/t17-,19-
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n/an/an/an/a 117n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147750
PNG
(1-[1-(Decahydro-naphthalen-2-yl)-piperidin-4-yl]-1...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCC2CCCCC2C1
Show InChI InChI=1S/C23H32N2O/c26-23-16-19-7-3-4-8-22(19)25(23)20-11-13-24(14-12-20)21-10-9-17-5-1-2-6-18(17)15-21/h3-4,7-8,17-18,20-21H,1-2,5-6,9-16H2
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n/an/an/an/a 16n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147744
PNG
(1-{1-[1-(4-Cyclohexyl-phenyl)-ethyl]-piperidin-4-y...)
Show SMILES CC(N1CCC(CC1)N1C(=O)Cc2ccccc12)c1ccc(cc1)C1CCCCC1
Show InChI InChI=1S/C27H34N2O/c1-20(21-11-13-23(14-12-21)22-7-3-2-4-8-22)28-17-15-25(16-18-28)29-26-10-6-5-9-24(26)19-27(29)30/h5-6,9-14,20,22,25H,2-4,7-8,15-19H2,1H3
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n/an/an/an/a>1.00E+4n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147749
PNG
(1-(1-Cyclooctylmethyl-piperidin-4-yl)-1,3-dihydro-...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC2CCCCCCC2)CC1
Show InChI InChI=1S/C22H32N2O/c25-22-16-19-10-6-7-11-21(19)24(22)20-12-14-23(15-13-20)17-18-8-4-2-1-3-5-9-18/h6-7,10-11,18,20H,1-5,8-9,12-17H2
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n/an/an/an/a>1.00E+4n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding NOP receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147735
PNG
(1-[1-(4-Isopropyl-cyclohexyl)-piperidin-4-yl]-1,3-...)
Show SMILES CC(C)[C@H]1CC[C@H](CC1)N1CCC(CC1)N1C(=O)Cc2ccccc12 |wD:6.9,3.2,(24.86,-7.21,;24.05,-5.88,;24.8,-4.53,;22.51,-5.93,;21.72,-4.6,;20.17,-4.65,;19.43,-6,;20.25,-7.31,;21.78,-7.28,;17.91,-6.04,;17.1,-4.72,;15.55,-4.77,;14.83,-6.12,;15.63,-7.44,;17.17,-7.39,;13.29,-6.16,;12.34,-4.95,;12.78,-3.47,;10.9,-5.46,;10.94,-7,;9.85,-8.05,;10.21,-9.57,;11.69,-9.99,;12.8,-8.93,;12.43,-7.42,)|
Show InChI InChI=1S/C22H32N2O/c1-16(2)17-7-9-19(10-8-17)23-13-11-20(12-14-23)24-21-6-4-3-5-18(21)15-22(24)25/h3-6,16-17,19-20H,7-15H2,1-2H3/t17-,19+
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n/an/an/an/a 26n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147740
PNG
(1-(1-Cyclooctyl-piperidin-4-yl)-1,3-dihydro-indol-...)
Show SMILES O=C1Cc2ccccc2N1C1CCN(CC1)C1CCCCCCC1
Show InChI InChI=1S/C21H30N2O/c24-21-16-17-8-6-7-11-20(17)23(21)19-12-14-22(15-13-19)18-9-4-2-1-3-5-10-18/h6-8,11,18-19H,1-5,9-10,12-16H2
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n/an/an/an/a 20n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50147748
PNG
(1-{1-[1-(9H-Fluoren-2-yl)-ethyl]-piperidin-4-yl}-1...)
Show SMILES CC(N1CCC(CC1)N1C(=O)Cc2ccccc12)c1ccc-2c(Cc3ccccc-23)c1
Show InChI InChI=1S/C28H28N2O/c1-19(20-10-11-26-23(16-20)17-21-6-2-4-8-25(21)26)29-14-12-24(13-15-29)30-27-9-5-3-7-22(27)18-28(30)31/h2-11,16,19,24H,12-15,17-18H2,1H3
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n/an/an/an/a>1.00E+4n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%