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Compile Data Set for Download or QSAR

Found 24 hits with Last Name = 'tronci' and Initial = 's'   
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
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088369
PNG
(1-{10-[3-(3-Chloro-phenyl)-allyl]-9,10-diaza-tricy...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1cccc(Cl)c1 |TLB:2:4:13:10.11,10:9:4:7.6,11:12:4:7.6,THB:7:8:13:10.11,6:5:13:10.11,14:13:4.5.8:10.11,14:13:4:7.6|
Show InChI InChI=1S/C20H25ClN2O/c1-2-20(24)23-18-10-11-19(23)17-9-8-16(18)22(17)12-4-6-14-5-3-7-15(21)13-14/h3-7,13,16-19H,2,8-12H2,1H3/b6-4+/t16-,17?,18-,19?/m0/s1
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1.30n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 was determined in rat brain homogenate using 3- arylpropenyl-8-propionyl-DBO derivative (3)


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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2.80n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Inhibition of [3H]-DAMGO binding to rat brain homogenat Opioid receptor mu 1


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088365
PNG
(1-[10-(3-Naphthalen-1-yl-allyl)-9,10-diaza-tricycl...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1cccc2ccccc12 |TLB:2:4:13:10.11,10:9:4:7.6,11:12:4:7.6,THB:14:13:4.5.8:10.11,14:13:4:7.6,7:8:13:10.11,6:5:13:10.11|
Show InChI InChI=1S/C24H28N2O/c1-2-24(27)26-22-14-15-23(26)21-13-12-20(22)25(21)16-6-10-18-9-5-8-17-7-3-4-11-19(17)18/h3-11,20-23H,2,12-16H2,1H3/b10-6+/t20-,21?,22-,23?/m0/s1
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4.66n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 was determined in rat brain homogenate using 3- arylpropenyl-8-propionyl-DBO derivative (3)


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088370
PNG
(1-{10-[3-(4-Nitro-phenyl)-allyl]-9,10-diaza-tricyc...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1ccc(cc1)[N+]([O-])=O |TLB:2:4:13:11.10,11:12:4:6.7,10:9:4:6.7,THB:14:13:4.5.8:11.10,14:13:4:6.7,6:5:13:11.10,7:8:13:11.10|
Show InChI InChI=1S/C20H25N3O3/c1-2-20(24)22-18-11-12-19(22)17-10-9-16(18)21(17)13-3-4-14-5-7-15(8-6-14)23(25)26/h3-8,16-19H,2,9-13H2,1H3/b4-3+/t16-,17?,18-,19?/m0/s1
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5.10n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 was determined in rat brain homogenate using 3- arylpropenyl-8-propionyl-DBO derivative (3)


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088361
PNG
(1-{10-[3-(3-Nitro-phenyl)-allyl]-9,10-diaza-tricyc...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1cccc(c1)[N+]([O-])=O |TLB:2:4:13:10.11,10:9:4:6.7,11:12:4:6.7,THB:14:13:4.5.8:10.11,14:13:4:6.7,6:5:13:10.11,7:8:13:10.11|
Show InChI InChI=1S/C20H25N3O3/c1-2-20(24)22-18-10-11-19(22)17-9-8-16(18)21(17)12-4-6-14-5-3-7-15(13-14)23(25)26/h3-7,13,16-19H,2,8-12H2,1H3/b6-4+/t16-,17?,18-,19?/m0/s1
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9.5n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 was determined in rat brain homogenate using 3- arylpropenyl-8-propionyl-DBO derivative (3)


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088361
PNG
(1-{10-[3-(3-Nitro-phenyl)-allyl]-9,10-diaza-tricyc...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1cccc(c1)[N+]([O-])=O |TLB:2:4:13:10.11,10:9:4:6.7,11:12:4:6.7,THB:14:13:4.5.8:10.11,14:13:4:6.7,6:5:13:10.11,7:8:13:10.11|
Show InChI InChI=1S/C20H25N3O3/c1-2-20(24)22-18-10-11-19(22)17-9-8-16(18)21(17)12-4-6-14-5-3-7-15(13-14)23(25)26/h3-7,13,16-19H,2,8-12H2,1H3/b6-4+/t16-,17?,18-,19?/m0/s1
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10n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 was determined in rat brain homogenate using 3- arylpropenyl-8-propionyl-DBO derivative (2)


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088362
PNG
(1-[10-(3-Phenyl-allyl)-9,10-diaza-tricyclo[4.2.1.1...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1ccccc1 |TLB:2:4:13:10.11,10:9:4:7.6,11:12:4:7.6,THB:7:8:13:10.11,6:5:13:10.11,14:13:4.5.8:10.11,14:13:4:7.6|
Show InChI InChI=1S/C20H26N2O/c1-2-20(23)22-18-12-13-19(22)17-11-10-16(18)21(17)14-6-9-15-7-4-3-5-8-15/h3-9,16-19H,2,10-14H2,1H3/b9-6+/t16-,17?,18-,19?/m0/s1
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10n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Inhibition of [3H]-DAMGO binding to rat brain homogenat Opioid receptor mu 1


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088369
PNG
(1-{10-[3-(3-Chloro-phenyl)-allyl]-9,10-diaza-tricy...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1cccc(Cl)c1 |TLB:2:4:13:10.11,10:9:4:7.6,11:12:4:7.6,THB:7:8:13:10.11,6:5:13:10.11,14:13:4.5.8:10.11,14:13:4:7.6|
Show InChI InChI=1S/C20H25ClN2O/c1-2-20(24)23-18-10-11-19(23)17-9-8-16(18)22(17)12-4-6-14-5-3-7-15(21)13-14/h3-7,13,16-19H,2,8-12H2,1H3/b6-4+/t16-,17?,18-,19?/m0/s1
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16.3n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 was determined in rat brain homogenate using 3- arylpropenyl-8-propionyl-DBO derivative (2)


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088365
PNG
(1-[10-(3-Naphthalen-1-yl-allyl)-9,10-diaza-tricycl...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1cccc2ccccc12 |TLB:2:4:13:10.11,10:9:4:7.6,11:12:4:7.6,THB:14:13:4.5.8:10.11,14:13:4:7.6,7:8:13:10.11,6:5:13:10.11|
Show InChI InChI=1S/C24H28N2O/c1-2-24(27)26-22-14-15-23(26)21-13-12-20(22)25(21)16-6-10-18-9-5-8-17-7-3-4-11-19(17)18/h3-11,20-23H,2,12-16H2,1H3/b10-6+/t20-,21?,22-,23?/m0/s1
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21.7n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 was determined in rat brain homogenate using 3- arylpropenyl-8-propionyl-DBO derivative (2)


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088370
PNG
(1-{10-[3-(4-Nitro-phenyl)-allyl]-9,10-diaza-tricyc...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1ccc(cc1)[N+]([O-])=O |TLB:2:4:13:11.10,11:12:4:6.7,10:9:4:6.7,THB:14:13:4.5.8:11.10,14:13:4:6.7,6:5:13:11.10,7:8:13:11.10|
Show InChI InChI=1S/C20H25N3O3/c1-2-20(24)22-18-11-12-19(22)17-10-9-16(18)21(17)13-3-4-14-5-7-15(8-6-14)23(25)26/h3-8,16-19H,2,9-13H2,1H3/b4-3+/t16-,17?,18-,19?/m0/s1
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23n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Inhibition of [3H]-DAMGO binding to rat brain homogenat Opioid receptor mu 1


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088370
PNG
(1-{10-[3-(4-Nitro-phenyl)-allyl]-9,10-diaza-tricyc...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1ccc(cc1)[N+]([O-])=O |TLB:2:4:13:11.10,11:12:4:6.7,10:9:4:6.7,THB:14:13:4.5.8:11.10,14:13:4:6.7,6:5:13:11.10,7:8:13:11.10|
Show InChI InChI=1S/C20H25N3O3/c1-2-20(24)22-18-11-12-19(22)17-10-9-16(18)21(17)13-3-4-14-5-7-15(8-6-14)23(25)26/h3-8,16-19H,2,9-13H2,1H3/b4-3+/t16-,17?,18-,19?/m0/s1
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25n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 was determined in rat brain homogenate using 3- arylpropenyl-8-propionyl-DBO derivative (2)


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088369
PNG
(1-{10-[3-(3-Chloro-phenyl)-allyl]-9,10-diaza-tricy...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1cccc(Cl)c1 |TLB:2:4:13:10.11,10:9:4:7.6,11:12:4:7.6,THB:7:8:13:10.11,6:5:13:10.11,14:13:4.5.8:10.11,14:13:4:7.6|
Show InChI InChI=1S/C20H25ClN2O/c1-2-20(24)23-18-10-11-19(23)17-9-8-16(18)22(17)12-4-6-14-5-3-7-15(21)13-14/h3-7,13,16-19H,2,8-12H2,1H3/b6-4+/t16-,17?,18-,19?/m0/s1
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36.6n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Inhibition of [3H]-DAMGO binding to rat brain homogenat Opioid receptor mu 1


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088361
PNG
(1-{10-[3-(3-Nitro-phenyl)-allyl]-9,10-diaza-tricyc...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1cccc(c1)[N+]([O-])=O |TLB:2:4:13:10.11,10:9:4:6.7,11:12:4:6.7,THB:14:13:4.5.8:10.11,14:13:4:6.7,6:5:13:10.11,7:8:13:10.11|
Show InChI InChI=1S/C20H25N3O3/c1-2-20(24)22-18-10-11-19(22)17-9-8-16(18)21(17)12-4-6-14-5-3-7-15(13-14)23(25)26/h3-7,13,16-19H,2,8-12H2,1H3/b6-4+/t16-,17?,18-,19?/m0/s1
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40n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Inhibition of [3H]-DAMGO binding to rat brain homogenat Opioid receptor mu 1


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088368
PNG
(1-[3-(3-Phenyl-allyl)-3,8-diaza-bicyclo[3.2.1]oct-...)
Show SMILES CCC(=O)N1C2CCC1CN(C\C=C\c1ccccc1)C2 |TLB:2:4:10.9.20:6.7,THB:11:10:4:6.7|
Show InChI InChI=1S/C18H24N2O/c1-2-18(21)20-16-10-11-17(20)14-19(13-16)12-6-9-15-7-4-3-5-8-15/h3-9,16-17H,2,10-14H2,1H3/b9-6+
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50n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Inhibition of [3H]-DAMGO binding to rat brain homogenat Opioid receptor mu 1


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088362
PNG
(1-[10-(3-Phenyl-allyl)-9,10-diaza-tricyclo[4.2.1.1...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1ccccc1 |TLB:2:4:13:10.11,10:9:4:7.6,11:12:4:7.6,THB:7:8:13:10.11,6:5:13:10.11,14:13:4.5.8:10.11,14:13:4:7.6|
Show InChI InChI=1S/C20H26N2O/c1-2-20(23)22-18-12-13-19(22)17-11-10-16(18)21(17)14-6-9-15-7-4-3-5-8-15/h3-9,16-19H,2,10-14H2,1H3/b9-6+/t16-,17?,18-,19?/m0/s1
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50n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 was determined in rat brain homogenate using 3- arylpropenyl-8-propionyl-DBO derivative (2)


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088362
PNG
(1-[10-(3-Phenyl-allyl)-9,10-diaza-tricyclo[4.2.1.1...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1ccccc1 |TLB:2:4:13:10.11,10:9:4:7.6,11:12:4:7.6,THB:7:8:13:10.11,6:5:13:10.11,14:13:4.5.8:10.11,14:13:4:7.6|
Show InChI InChI=1S/C20H26N2O/c1-2-20(23)22-18-12-13-19(22)17-11-10-16(18)21(17)14-6-9-15-7-4-3-5-8-15/h3-9,16-19H,2,10-14H2,1H3/b9-6+/t16-,17?,18-,19?/m0/s1
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160n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 was determined in rat brain homogenate using 3- arylpropenyl-8-propionyl-DBO derivative (3)


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088371
PNG
(1-[8-(3-Phenyl-allyl)-3,8-diaza-bicyclo[3.2.1]oct-...)
Show SMILES CCC(=O)N1CC2CCC(C1)N2C\C=C\c1ccccc1 |TLB:2:4:11:7.8|
Show InChI InChI=1S/C18H24N2O/c1-2-18(21)19-13-16-10-11-17(14-19)20(16)12-6-9-15-7-4-3-5-8-15/h3-9,16-17H,2,10-14H2,1H3/b9-6+
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160n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Inhibition of [3H]-DAMGO binding to rat brain homogenat Opioid receptor mu 1


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088365
PNG
(1-[10-(3-Naphthalen-1-yl-allyl)-9,10-diaza-tricycl...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1cccc2ccccc12 |TLB:2:4:13:10.11,10:9:4:7.6,11:12:4:7.6,THB:14:13:4.5.8:10.11,14:13:4:7.6,7:8:13:10.11,6:5:13:10.11|
Show InChI InChI=1S/C24H28N2O/c1-2-24(27)26-22-14-15-23(26)21-13-12-20(22)25(21)16-6-10-18-9-5-8-17-7-3-4-11-19(17)18/h3-11,20-23H,2,12-16H2,1H3/b10-6+/t20-,21?,22-,23?/m0/s1
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180n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Inhibition of [3H]-DAMGO binding to rat brain homogenat Opioid receptor mu 1


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50088361
PNG
(1-{10-[3-(3-Nitro-phenyl)-allyl]-9,10-diaza-tricyc...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1cccc(c1)[N+]([O-])=O |TLB:2:4:13:10.11,10:9:4:6.7,11:12:4:6.7,THB:14:13:4.5.8:10.11,14:13:4:6.7,6:5:13:10.11,7:8:13:10.11|
Show InChI InChI=1S/C20H25N3O3/c1-2-20(24)22-18-10-11-19(22)17-9-8-16(18)21(17)12-4-6-14-5-3-7-15(13-14)23(25)26/h3-7,13,16-19H,2,8-12H2,1H3/b6-4+/t16-,17?,18-,19?/m0/s1
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750n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor kappa 1 was determined in guinea pig homogenate using [3H]-U-69,593 as radioligand


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088362
PNG
(1-[10-(3-Phenyl-allyl)-9,10-diaza-tricyclo[4.2.1.1...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1ccccc1 |TLB:2:4:13:10.11,10:9:4:7.6,11:12:4:7.6,THB:7:8:13:10.11,6:5:13:10.11,14:13:4.5.8:10.11,14:13:4:7.6|
Show InChI InChI=1S/C20H26N2O/c1-2-20(23)22-18-12-13-19(22)17-11-10-16(18)21(17)14-6-9-15-7-4-3-5-8-15/h3-9,16-19H,2,10-14H2,1H3/b9-6+/t16-,17?,18-,19?/m0/s1
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2.27E+3n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor delta 1 was determined in rat brain homogenate using [3H]-deltorphin II as radioligand


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50088362
PNG
(1-[10-(3-Phenyl-allyl)-9,10-diaza-tricyclo[4.2.1.1...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1ccccc1 |TLB:2:4:13:10.11,10:9:4:7.6,11:12:4:7.6,THB:7:8:13:10.11,6:5:13:10.11,14:13:4.5.8:10.11,14:13:4:7.6|
Show InChI InChI=1S/C20H26N2O/c1-2-20(23)22-18-12-13-19(22)17-11-10-16(18)21(17)14-6-9-15-7-4-3-5-8-15/h3-9,16-19H,2,10-14H2,1H3/b9-6+/t16-,17?,18-,19?/m0/s1
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3.00E+3n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor kappa 1 was determined in guinea pig homogenate using [3H]-U-69,593 as radioligand


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088361
PNG
(1-{10-[3-(3-Nitro-phenyl)-allyl]-9,10-diaza-tricyc...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1cccc(c1)[N+]([O-])=O |TLB:2:4:13:10.11,10:9:4:6.7,11:12:4:6.7,THB:14:13:4.5.8:10.11,14:13:4:6.7,6:5:13:10.11,7:8:13:10.11|
Show InChI InChI=1S/C20H25N3O3/c1-2-20(24)22-18-10-11-19(22)17-9-8-16(18)21(17)12-4-6-14-5-3-7-15(13-14)23(25)26/h3-7,13,16-19H,2,8-12H2,1H3/b6-4+/t16-,17?,18-,19?/m0/s1
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7.50E+3n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor delta 1 was determined in rat brain homogenate using [3H]-deltorphin II as radioligand


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50088370
PNG
(1-{10-[3-(4-Nitro-phenyl)-allyl]-9,10-diaza-tricyc...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1ccc(cc1)[N+]([O-])=O |TLB:2:4:13:11.10,11:12:4:6.7,10:9:4:6.7,THB:14:13:4.5.8:11.10,14:13:4:6.7,6:5:13:11.10,7:8:13:11.10|
Show InChI InChI=1S/C20H25N3O3/c1-2-20(24)22-18-11-12-19(22)17-10-9-16(18)21(17)13-3-4-14-5-7-15(8-6-14)23(25)26/h3-8,16-19H,2,9-13H2,1H3/b4-3+/t16-,17?,18-,19?/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor kappa 1 was determined in guinea pig homogenate using [3H]-U-69,593 as radioligand


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50088370
PNG
(1-{10-[3-(4-Nitro-phenyl)-allyl]-9,10-diaza-tricyc...)
Show SMILES CCC(=O)N1C2CC[C@H]1[C@@H]1CCC2N1C\C=C\c1ccc(cc1)[N+]([O-])=O |TLB:2:4:13:11.10,11:12:4:6.7,10:9:4:6.7,THB:14:13:4.5.8:11.10,14:13:4:6.7,6:5:13:11.10,7:8:13:11.10|
Show InChI InChI=1S/C20H25N3O3/c1-2-20(24)22-18-11-12-19(22)17-10-9-16(18)21(17)13-3-4-14-5-7-15(8-6-14)23(25)26/h3-8,16-19H,2,9-13H2,1H3/b4-3+/t16-,17?,18-,19?/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



Istituto di Chimica Farmaceutica e Tossicologica

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor delta 1 was determined in rat brain homogenate using [3H]-deltorphin II as radioligand


J Med Chem 43: 2115-23 (2000)


BindingDB Entry DOI: 10.7270/Q22N51HT
More data for this
Ligand-Target Pair