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Compile Data Set for Download or QSAR

Found 120 hits with Last Name = 'cowley' and Initial = 'pm'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50418229
PNG
(CHEMBL1760646)
Show SMILES COc1ccc(OC(F)(F)F)cc1Cn1c(cc2cc(ccc12)C#N)C(=O)NCC(C)(C)CO
Show InChI InChI=1S/C24H24F3N3O4/c1-23(2,14-31)13-29-22(32)20-10-16-8-15(11-28)4-6-19(16)30(20)12-17-9-18(34-24(25,26)27)5-7-21(17)33-3/h4-10,31H,12-14H2,1-3H3,(H,29,32)
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0.398n/an/an/an/an/an/an/an/a



MSD

Curated by ChEMBL


Assay Description
Displacement of [3H]SR141716A from human CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 21: 2034-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.019
BindingDB Entry DOI: 10.7270/Q27082PM
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50418228
PNG
(CHEMBL1760645)
Show SMILES CC(C)(CO)CNC(=O)c1cc2cc(ccc2n1Cc1cccc(OC(F)(F)F)c1)C#N
Show InChI InChI=1S/C23H22F3N3O3/c1-22(2,14-30)13-28-21(31)20-10-17-8-15(11-27)6-7-19(17)29(20)12-16-4-3-5-18(9-16)32-23(24,25)26/h3-10,30H,12-14H2,1-2H3,(H,28,31)
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0.794n/an/an/an/an/an/an/an/a



MSD

Curated by ChEMBL


Assay Description
Displacement of [3H]SR141716A from human CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 21: 2034-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.019
BindingDB Entry DOI: 10.7270/Q27082PM
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM21278
PNG
(5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl...)
Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1
Show InChI InChI=1S/C22H21Cl3N4O/c1-14-20(22(30)27-28-11-3-2-4-12-28)26-29(19-10-9-17(24)13-18(19)25)21(14)15-5-7-16(23)8-6-15/h5-10,13H,2-4,11-12H2,1H3,(H,27,30)
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0.933n/an/an/an/an/an/an/an/a



MSD

Curated by ChEMBL


Assay Description
Displacement of [3H]SR141716A from human CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 21: 2034-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.019
BindingDB Entry DOI: 10.7270/Q27082PM
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159903
PNG
(1-{1-[3-(2-Chloro-5-methoxy-phenoxy)-4-methyl-pent...)
Show SMILES COc1ccc(Cl)c(OC(CCN2CCC(CC2)n2c3ccccc3[nH]c2=O)C(C)C)c1
Show InChI InChI=1S/C25H32ClN3O3/c1-17(2)23(32-24-16-19(31-3)8-9-20(24)26)12-15-28-13-10-18(11-14-28)29-22-7-5-4-6-21(22)27-25(29)30/h4-9,16-18,23H,10-15H2,1-3H3,(H,27,30)
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3n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50200597
PNG
(1-(1-(3-(5-methoxy-2-methylphenoxy)-4-methylpentyl...)
Show SMILES COc1ccc(C)c(OC(CCN2CCC(CC2)n2c3ccccc3[nH]c2=O)C(C)C)c1 |w:9.8|
Show InChI InChI=1S/C26H35N3O3/c1-18(2)24(32-25-17-21(31-4)10-9-19(25)3)13-16-28-14-11-20(12-15-28)29-23-8-6-5-7-22(23)27-26(29)30/h5-10,17-18,20,24H,11-16H2,1-4H3,(H,27,30)
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4n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50418210
PNG
(CHEMBL1760664)
Show SMILES Cc1ccc(cc1Cn1c(cc2cc(ccc12)C#N)C(=O)NCCC(C)(C)O)C(F)(F)F
Show InChI InChI=1S/C24H24F3N3O2/c1-15-4-6-19(24(25,26)27)11-18(15)14-30-20-7-5-16(13-28)10-17(20)12-21(30)22(31)29-9-8-23(2,3)32/h4-7,10-12,32H,8-9,14H2,1-3H3,(H,29,31)
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4.37n/an/an/an/an/an/an/an/a



MSD

Curated by ChEMBL


Assay Description
Displacement of [3H]SR141716A from human CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 21: 2034-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.019
BindingDB Entry DOI: 10.7270/Q27082PM
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50418212
PNG
(CHEMBL1760663)
Show SMILES CC(C)(O)CCNC(=O)c1cc2cc(ccc2n1Cc1cccc(OC(F)(F)F)c1)C#N
Show InChI InChI=1S/C23H22F3N3O3/c1-22(2,31)8-9-28-21(30)20-12-17-10-15(13-27)6-7-19(17)29(20)14-16-4-3-5-18(11-16)32-23(24,25)26/h3-7,10-12,31H,8-9,14H2,1-2H3,(H,28,30)
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5.01n/an/an/an/an/an/an/an/a



MSD

Curated by ChEMBL


Assay Description
Displacement of [3H]SR141716A from human CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 21: 2034-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.019
BindingDB Entry DOI: 10.7270/Q27082PM
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50418213
PNG
(CHEMBL1760661)
Show SMILES COc1ccc(OC(F)(F)F)cc1Cn1c(cc2cc(ccc12)C#N)C(=O)NCC(C)(C)O
Show InChI InChI=1S/C23H22F3N3O4/c1-22(2,31)13-28-21(30)19-10-15-8-14(11-27)4-6-18(15)29(19)12-16-9-17(33-23(24,25)26)5-7-20(16)32-3/h4-10,31H,12-13H2,1-3H3,(H,28,30)
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5.5n/an/an/an/an/an/an/an/a



MSD

Curated by ChEMBL


Assay Description
Displacement of [3H]SR141716A from human CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 21: 2034-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.019
BindingDB Entry DOI: 10.7270/Q27082PM
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50418211
PNG
(CHEMBL1760662)
Show SMILES COc1ccc(cc1Cn1c(cc2cc(ccc12)C#N)C(=O)NCC(C)(C)O)C(F)(F)F
Show InChI InChI=1S/C23H22F3N3O3/c1-22(2,31)13-28-21(30)19-10-15-8-14(11-27)4-6-18(15)29(19)12-16-9-17(23(24,25)26)5-7-20(16)32-3/h4-10,31H,12-13H2,1-3H3,(H,28,30)
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7.59n/an/an/an/an/an/an/an/a



MSD

Curated by ChEMBL


Assay Description
Displacement of [3H]SR141716A from human CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 21: 2034-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.019
BindingDB Entry DOI: 10.7270/Q27082PM
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159902
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-3-phenyl-propy...)
Show SMILES Cc1ccc(Cl)c(OC(CCN2CCC(CC2)n2c3ccccc3[nH]c2=O)c2ccccc2)c1
Show InChI InChI=1S/C28H30ClN3O2/c1-20-11-12-23(29)27(19-20)34-26(21-7-3-2-4-8-21)15-18-31-16-13-22(14-17-31)32-25-10-6-5-9-24(25)30-28(32)33/h2-12,19,22,26H,13-18H2,1H3,(H,30,33)
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8.30n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159897
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-4-methyl-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1cc(C)ccc1Cl
Show InChI InChI=1S/C25H32ClN3O2/c1-17(2)23(31-24-16-18(3)8-9-20(24)26)12-15-28-13-10-19(11-14-28)29-22-7-5-4-6-21(22)27-25(29)30/h4-9,16-17,19,23H,10-15H2,1-3H3,(H,27,30)
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10.8n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159921
PNG
(1-{1-[3-(2,5-Dimethyl-phenoxy)-4-methyl-pentyl]-pi...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1cc(C)ccc1C
Show InChI InChI=1S/C26H35N3O2/c1-18(2)24(31-25-17-19(3)9-10-20(25)4)13-16-28-14-11-21(12-15-28)29-23-8-6-5-7-22(23)27-26(29)30/h5-10,17-18,21,24H,11-16H2,1-4H3,(H,27,30)
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11n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159897
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-4-methyl-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1cc(C)ccc1Cl
Show InChI InChI=1S/C25H32ClN3O2/c1-17(2)23(31-24-16-18(3)8-9-20(24)26)12-15-28-13-10-19(11-14-28)29-22-7-5-4-6-21(22)27-25(29)30/h4-9,16-17,19,23H,10-15H2,1-3H3,(H,27,30)
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11n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159904
PNG
(1-(1-{2-[1-(2-Chloro-5-methyl-phenoxy)-cyclohexyl]...)
Show SMILES Cc1ccc(Cl)c(OC2(CCCCC2)C(O)CN2CCC(CC2)n2c3ccccc3[nH]c2=O)c1
Show InChI InChI=1S/C27H34ClN3O3/c1-19-9-10-21(28)24(17-19)34-27(13-5-2-6-14-27)25(32)18-30-15-11-20(12-16-30)31-23-8-4-3-7-22(23)29-26(31)33/h3-4,7-10,17,20,25,32H,2,5-6,11-16,18H2,1H3,(H,29,33)
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12n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159900
PNG
(1-{1-[3-(5-Amino-2-methyl-phenoxy)-4-methyl-pentyl...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1cc(N)ccc1C
Show InChI InChI=1S/C25H34N4O2/c1-17(2)23(31-24-16-19(26)9-8-18(24)3)12-15-28-13-10-20(11-14-28)29-22-7-5-4-6-21(22)27-25(29)30/h4-9,16-17,20,23H,10-15,26H2,1-3H3,(H,27,30)
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14n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159902
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-3-phenyl-propy...)
Show SMILES Cc1ccc(Cl)c(OC(CCN2CCC(CC2)n2c3ccccc3[nH]c2=O)c2ccccc2)c1
Show InChI InChI=1S/C28H30ClN3O2/c1-20-11-12-23(29)27(19-20)34-26(21-7-3-2-4-8-21)15-18-31-16-13-22(14-17-31)32-25-10-6-5-9-24(25)30-28(32)33/h2-12,19,22,26H,13-18H2,1H3,(H,30,33)
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16.7n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159915
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-2-hydroxy-hexy...)
Show SMILES CCCC(Oc1cc(C)ccc1Cl)C(O)CN1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C25H32ClN3O3/c1-3-6-23(32-24-15-17(2)9-10-19(24)26)22(30)16-28-13-11-18(12-14-28)29-21-8-5-4-7-20(21)27-25(29)31/h4-5,7-10,15,18,22-23,30H,3,6,11-14,16H2,1-2H3,(H,27,31)
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20n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159913
PNG
(1-{1-[3-(2-Isopropyl-phenoxy)-4-methyl-pentyl]-pip...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1ccccc1C(C)C
Show InChI InChI=1S/C27H37N3O2/c1-19(2)22-9-5-8-12-26(22)32-25(20(3)4)15-18-29-16-13-21(14-17-29)30-24-11-7-6-10-23(24)28-27(30)31/h5-12,19-21,25H,13-18H2,1-4H3,(H,28,31)
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20n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159916
PNG
(1-[1-(4-Methyl-3-o-tolyloxy-pentyl)-piperidin-4-yl...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1ccccc1C
Show InChI InChI=1S/C25H33N3O2/c1-18(2)23(30-24-11-7-4-8-19(24)3)14-17-27-15-12-20(13-16-27)28-22-10-6-5-9-21(22)26-25(28)29/h4-11,18,20,23H,12-17H2,1-3H3,(H,26,29)
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21n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159905
PNG
(1-{1-[3-(2-Ethyl-phenoxy)-4-methyl-pentyl]-piperid...)
Show SMILES CCc1ccccc1OC(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)C(C)C
Show InChI InChI=1S/C26H35N3O2/c1-4-20-9-5-8-12-25(20)31-24(19(2)3)15-18-28-16-13-21(14-17-28)29-23-11-7-6-10-22(23)27-26(29)30/h5-12,19,21,24H,4,13-18H2,1-3H3,(H,27,30)
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23n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159922
PNG
(1-{1-[4-Methyl-3-(2-trifluoromethyl-phenoxy)-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1ccccc1C(F)(F)F
Show InChI InChI=1S/C25H30F3N3O2/c1-17(2)22(33-23-10-6-3-7-19(23)25(26,27)28)13-16-30-14-11-18(12-15-30)31-21-9-5-4-8-20(21)29-24(31)32/h3-10,17-18,22H,11-16H2,1-2H3,(H,29,32)
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24n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159922
PNG
(1-{1-[4-Methyl-3-(2-trifluoromethyl-phenoxy)-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1ccccc1C(F)(F)F
Show InChI InChI=1S/C25H30F3N3O2/c1-17(2)22(33-23-10-6-3-7-19(23)25(26,27)28)13-16-30-14-11-18(12-15-30)31-21-9-5-4-8-20(21)29-24(31)32/h3-10,17-18,22H,11-16H2,1-2H3,(H,29,32)
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24n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159917
PNG
(1-{1-[3-(2-Fluoro-5-methyl-phenoxy)-4-methyl-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1cc(C)ccc1F
Show InChI InChI=1S/C25H32FN3O2/c1-17(2)23(31-24-16-18(3)8-9-20(24)26)12-15-28-13-10-19(11-14-28)29-22-7-5-4-6-21(22)27-25(29)30/h4-9,16-17,19,23H,10-15H2,1-3H3,(H,27,30)
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25n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159915
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-2-hydroxy-hexy...)
Show SMILES CCCC(Oc1cc(C)ccc1Cl)C(O)CN1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C25H32ClN3O3/c1-3-6-23(32-24-15-17(2)9-10-19(24)26)22(30)16-28-13-11-18(12-14-28)29-21-8-5-4-7-20(21)27-25(29)31/h4-5,7-10,15,18,22-23,30H,3,6,11-14,16H2,1-2H3,(H,27,31)
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27n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159909
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-2-hydroxy-5-me...)
Show SMILES CC(C)CC(Oc1cc(C)ccc1Cl)C(O)CN1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C26H34ClN3O3/c1-17(2)14-25(33-24-15-18(3)8-9-20(24)27)23(31)16-29-12-10-19(11-13-29)30-22-7-5-4-6-21(22)28-26(30)32/h4-9,15,17,19,23,25,31H,10-14,16H2,1-3H3,(H,28,32)
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28n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159923
PNG
(1-{1-[3-(4-Fluoro-2-methyl-phenoxy)-4-methyl-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1ccc(F)cc1C
Show InChI InChI=1S/C25H32FN3O2/c1-17(2)23(31-24-9-8-19(26)16-18(24)3)12-15-28-13-10-20(11-14-28)29-22-7-5-4-6-21(22)27-25(29)30/h4-9,16-17,20,23H,10-15H2,1-3H3,(H,27,30)
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32n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159905
PNG
(1-{1-[3-(2-Ethyl-phenoxy)-4-methyl-pentyl]-piperid...)
Show SMILES CCc1ccccc1OC(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)C(C)C
Show InChI InChI=1S/C26H35N3O2/c1-4-20-9-5-8-12-25(20)31-24(19(2)3)15-18-28-16-13-21(14-17-28)29-23-11-7-6-10-22(23)27-26(29)30/h5-12,19,21,24H,4,13-18H2,1-3H3,(H,27,30)
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37n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159923
PNG
(1-{1-[3-(4-Fluoro-2-methyl-phenoxy)-4-methyl-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1ccc(F)cc1C
Show InChI InChI=1S/C25H32FN3O2/c1-17(2)23(31-24-9-8-19(26)16-18(24)3)12-15-28-13-10-20(11-14-28)29-22-7-5-4-6-21(22)27-25(29)30/h4-9,16-17,20,23H,10-15H2,1-3H3,(H,27,30)
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38n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159918
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-2-hydroxy-3-ph...)
Show SMILES Cc1ccc(Cl)c(OC(C(O)CN2CCC(CC2)n2c3ccccc3[nH]c2=O)c2ccccc2)c1
Show InChI InChI=1S/C28H30ClN3O3/c1-19-11-12-22(29)26(17-19)35-27(20-7-3-2-4-8-20)25(33)18-31-15-13-21(14-16-31)32-24-10-6-5-9-23(24)30-28(32)34/h2-12,17,21,25,27,33H,13-16,18H2,1H3,(H,30,34)
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38.2n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159914
PNG
(1-{1-[4-Methyl-3-(5-methyl-2-nitro-phenoxy)-pentyl...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[n-]c1=[OH+])Oc1cc(C)ccc1[N+]([O-])=O
Show InChI InChI=1S/C25H32N4O4/c1-17(2)23(33-24-16-18(3)8-9-22(24)29(31)32)12-15-27-13-10-19(11-14-27)28-21-7-5-4-6-20(21)26-25(28)30/h4-9,16-17,19,23H,10-15H2,1-3H3,(H,26,30)
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39n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159916
PNG
(1-[1-(4-Methyl-3-o-tolyloxy-pentyl)-piperidin-4-yl...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1ccccc1C
Show InChI InChI=1S/C25H33N3O2/c1-18(2)23(30-24-11-7-4-8-19(24)3)14-17-27-15-12-20(13-16-27)28-22-10-6-5-9-21(22)26-25(28)29/h4-11,18,20,23H,12-17H2,1-3H3,(H,26,29)
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42n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159924
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-2-hydroxy-pent...)
Show SMILES CCC(Oc1cc(C)ccc1Cl)C(O)CN1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C24H30ClN3O3/c1-3-22(31-23-14-16(2)8-9-18(23)25)21(29)15-27-12-10-17(11-13-27)28-20-7-5-4-6-19(20)26-24(28)30/h4-9,14,17,21-22,29H,3,10-13,15H2,1-2H3,(H,26,30)
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45n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159900
PNG
(1-{1-[3-(5-Amino-2-methyl-phenoxy)-4-methyl-pentyl...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1cc(N)ccc1C
Show InChI InChI=1S/C25H34N4O2/c1-17(2)23(31-24-16-19(26)9-8-18(24)3)12-15-28-13-10-20(11-14-28)29-22-7-5-4-6-21(22)27-25(29)30/h4-9,16-17,20,23H,10-15,26H2,1-3H3,(H,27,30)
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47n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159907
PNG
(1-{1-[3-(4-Fluoro-3-methyl-phenoxy)-4-methyl-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1ccc(F)c(C)c1
Show InChI InChI=1S/C25H32FN3O2/c1-17(2)24(31-20-8-9-21(26)18(3)16-20)12-15-28-13-10-19(11-14-28)29-23-7-5-4-6-22(23)27-25(29)30/h4-9,16-17,19,24H,10-15H2,1-3H3,(H,27,30)
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52n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159906
PNG
(1-{1-[3-(2-Chloro-5-fluoro-phenoxy)-4-methyl-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1cc(F)ccc1Cl
Show InChI InChI=1S/C24H29ClFN3O2/c1-16(2)22(31-23-15-17(26)7-8-19(23)25)11-14-28-12-9-18(10-13-28)29-21-6-4-3-5-20(21)27-24(29)30/h3-8,15-16,18,22H,9-14H2,1-2H3,(H,27,30)
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56n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159903
PNG
(1-{1-[3-(2-Chloro-5-methoxy-phenoxy)-4-methyl-pent...)
Show SMILES COc1ccc(Cl)c(OC(CCN2CCC(CC2)n2c3ccccc3[nH]c2=O)C(C)C)c1
Show InChI InChI=1S/C25H32ClN3O3/c1-17(2)23(32-24-16-19(31-3)8-9-20(24)26)12-15-28-13-10-18(11-14-28)29-22-7-5-4-6-21(22)27-25(29)30/h4-9,16-18,23H,10-15H2,1-3H3,(H,27,30)
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58n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159904
PNG
(1-(1-{2-[1-(2-Chloro-5-methyl-phenoxy)-cyclohexyl]...)
Show SMILES Cc1ccc(Cl)c(OC2(CCCCC2)C(O)CN2CCC(CC2)n2c3ccccc3[nH]c2=O)c1
Show InChI InChI=1S/C27H34ClN3O3/c1-19-9-10-21(28)24(17-19)34-27(13-5-2-6-14-27)25(32)18-30-15-11-20(12-16-30)31-23-8-4-3-7-22(23)29-26(31)33/h3-4,7-10,17,20,25,32H,2,5-6,11-16,18H2,1H3,(H,29,33)
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58n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50200597
PNG
(1-(1-(3-(5-methoxy-2-methylphenoxy)-4-methylpentyl...)
Show SMILES COc1ccc(C)c(OC(CCN2CCC(CC2)n2c3ccccc3[nH]c2=O)C(C)C)c1 |w:9.8|
Show InChI InChI=1S/C26H35N3O3/c1-18(2)24(32-25-17-21(31-4)10-9-19(25)3)13-16-28-14-11-20(12-15-28)29-23-8-6-5-7-22(23)27-26(29)30/h5-10,17-18,20,24H,11-16H2,1-4H3,(H,27,30)
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59n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159924
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-2-hydroxy-pent...)
Show SMILES CCC(Oc1cc(C)ccc1Cl)C(O)CN1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C24H30ClN3O3/c1-3-22(31-23-14-16(2)8-9-18(23)25)21(29)15-27-12-10-17(11-13-27)28-20-7-5-4-6-19(20)26-24(28)30/h4-9,14,17,21-22,29H,3,10-13,15H2,1-2H3,(H,26,30)
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60n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159914
PNG
(1-{1-[4-Methyl-3-(5-methyl-2-nitro-phenoxy)-pentyl...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[n-]c1=[OH+])Oc1cc(C)ccc1[N+]([O-])=O
Show InChI InChI=1S/C25H32N4O4/c1-17(2)23(33-24-16-18(3)8-9-22(24)29(31)32)12-15-27-13-10-19(11-14-27)28-21-7-5-4-6-20(21)26-25(28)30/h4-9,16-17,19,23H,10-15H2,1-3H3,(H,26,30)
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62n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159921
PNG
(1-{1-[3-(2,5-Dimethyl-phenoxy)-4-methyl-pentyl]-pi...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1cc(C)ccc1C
Show InChI InChI=1S/C26H35N3O2/c1-18(2)24(31-25-17-19(3)9-10-20(25)4)13-16-28-14-11-21(12-15-28)29-23-8-6-5-7-22(23)27-26(29)30/h5-10,17-18,21,24H,11-16H2,1-4H3,(H,27,30)
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65n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159897
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-4-methyl-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1cc(C)ccc1Cl
Show InChI InChI=1S/C25H32ClN3O2/c1-17(2)23(31-24-16-18(3)8-9-20(24)26)12-15-28-13-10-19(11-14-28)29-22-7-5-4-6-21(22)27-25(29)30/h4-9,16-17,19,23H,10-15H2,1-3H3,(H,27,30)
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65n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159897
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-4-methyl-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1cc(C)ccc1Cl
Show InChI InChI=1S/C25H32ClN3O2/c1-17(2)23(31-24-16-18(3)8-9-20(24)26)12-15-28-13-10-19(11-14-28)29-22-7-5-4-6-21(22)27-25(29)30/h4-9,16-17,19,23H,10-15H2,1-3H3,(H,27,30)
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65.2n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159917
PNG
(1-{1-[3-(2-Fluoro-5-methyl-phenoxy)-4-methyl-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1cc(C)ccc1F
Show InChI InChI=1S/C25H32FN3O2/c1-17(2)23(31-24-16-18(3)8-9-20(24)26)12-15-28-13-10-19(11-14-28)29-22-7-5-4-6-21(22)27-25(29)30/h4-9,16-17,19,23H,10-15H2,1-3H3,(H,27,30)
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67n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159919
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-2-hydroxy-4-me...)
Show SMILES CC(C)C(Oc1cc(C)ccc1Cl)C(O)CN1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C25H32ClN3O3/c1-16(2)24(32-23-14-17(3)8-9-19(23)26)22(30)15-28-12-10-18(11-13-28)29-21-7-5-4-6-20(21)27-25(29)31/h4-9,14,16,18,22,24,30H,10-13,15H2,1-3H3,(H,27,31)
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88n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159927
PNG
(1-(1-{2-[1-(2-Chloro-5-methyl-phenoxy)-cyclohexyl]...)
Show SMILES CN(C)C(CN1CCC(CC1)n1c2ccccc2[nH]c1=O)C1(CCCCC1)Oc1cc(C)ccc1Cl
Show InChI InChI=1S/C29H39ClN4O2/c1-21-11-12-23(30)26(19-21)36-29(15-7-4-8-16-29)27(32(2)3)20-33-17-13-22(14-18-33)34-25-10-6-5-9-24(25)31-28(34)35/h5-6,9-12,19,22,27H,4,7-8,13-18,20H2,1-3H3,(H,31,35)
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102n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159899
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-3-cyclohexyl-2...)
Show SMILES Cc1ccc(Cl)c(OC(C(O)CN2CCC(CC2)n2c3ccccc3[nH]c2=O)C2CCCCC2)c1
Show InChI InChI=1S/C28H36ClN3O3/c1-19-11-12-22(29)26(17-19)35-27(20-7-3-2-4-8-20)25(33)18-31-15-13-21(14-16-31)32-24-10-6-5-9-23(24)30-28(32)34/h5-6,9-12,17,20-21,25,27,33H,2-4,7-8,13-16,18H2,1H3,(H,30,34)
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103n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50159907
PNG
(1-{1-[3-(4-Fluoro-3-methyl-phenoxy)-4-methyl-penty...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1ccc(F)c(C)c1
Show InChI InChI=1S/C25H32FN3O2/c1-17(2)24(31-20-8-9-21(26)18(3)16-20)12-15-28-13-10-19(11-14-28)29-23-7-5-4-6-22(23)27-25(29)30/h4-9,16-17,19,24H,10-15H2,1-3H3,(H,27,30)
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103n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159919
PNG
(1-{1-[3-(2-Chloro-5-methyl-phenoxy)-2-hydroxy-4-me...)
Show SMILES CC(C)C(Oc1cc(C)ccc1Cl)C(O)CN1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C25H32ClN3O3/c1-16(2)24(32-23-14-17(3)8-9-19(23)26)22(30)15-28-12-10-18(11-13-28)29-21-7-5-4-6-20(21)27-25(29)31/h4-9,14,16,18,22,24,30H,10-13,15H2,1-3H3,(H,27,31)
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108n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50159913
PNG
(1-{1-[3-(2-Isopropyl-phenoxy)-4-methyl-pentyl]-pip...)
Show SMILES CC(C)C(CCN1CCC(CC1)n1c2ccccc2[nH]c1=O)Oc1ccccc1C(C)C
Show InChI InChI=1S/C27H37N3O2/c1-19(2)22-9-5-8-12-26(22)32-25(20(3)4)15-18-29-16-13-21(14-17-29)30-24-11-7-6-10-23(24)28-27(30)31/h5-12,19-21,25H,13-18H2,1-4H3,(H,28,31)
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113n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...


Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair
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