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PubMed code 2571729

Compile data set for download or QSAR
Found 15 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
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50017519
PNG
(1,1-Diethyl-3-(7-methyl-4,6,6a,7,8,9,10,10a-octahy...)
Show SMILES CCN(CC)C(=O)N[C@H]1C[C@H]2[C@@H](Cc3c[nH]c4cccc2c34)N(C)C1
Show InChI InChI=1S/C20H28N4O/c1-4-24(5-2)20(25)22-14-10-16-15-7-6-8-17-19(15)13(11-21-17)9-18(16)23(3)12-14/h6-8,11,14,16,18,21H,4-5,9-10,12H2,1-3H3,(H,22,25)/t14-,16+,18+/m0/s1
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n/an/a 4n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against dopamine receptor D2 from homogenized rat brain, using [3H]spiperone as the radioligand


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM21393
PNG
(7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-o...)
Show SMILES CCCN(CCC)C1CCc2cccc(O)c2C1
Show InChI InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3
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n/an/a 4.5n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against 5-hydroxytryptamine 1A receptor receptor from homogenized rat brain, using [3H]8-OH-DPAT as the radioligand


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50017519
PNG
(1,1-Diethyl-3-(7-methyl-4,6,6a,7,8,9,10,10a-octahy...)
Show SMILES CCN(CC)C(=O)N[C@H]1C[C@H]2[C@@H](Cc3c[nH]c4cccc2c34)N(C)C1
Show InChI InChI=1S/C20H28N4O/c1-4-24(5-2)20(25)22-14-10-16-15-7-6-8-17-19(15)13(11-21-17)9-18(16)23(3)12-14/h6-8,11,14,16,18,21H,4-5,9-10,12H2,1-3H3,(H,22,25)/t14-,16+,18+/m0/s1
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n/an/a 25n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against 5-hydroxytryptamine 1A receptor from homogenized rat brain, using [3H]-8-OH-DPAT as the radioligand


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50044236
PNG
(CHEMBL303339 | Dimethyl-(R)-6,7,8,9-tetrahydro-3H-...)
Show SMILES CN(C)[C@@H]1CCc2ccc3[nH]ccc3c2C1
Show InChI InChI=1S/C14H18N2/c1-16(2)11-5-3-10-4-6-14-12(7-8-15-14)13(10)9-11/h4,6-8,11,15H,3,5,9H2,1-2H3/t11-/m1/s1
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n/an/a 31n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against 5-hydroxytryptamine 1A receptor from homogenized rat brain, using [3H]8-OH-DPAT as the radioligand.


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50017519
PNG
(1,1-Diethyl-3-(7-methyl-4,6,6a,7,8,9,10,10a-octahy...)
Show SMILES CCN(CC)C(=O)N[C@H]1C[C@H]2[C@@H](Cc3c[nH]c4cccc2c34)N(C)C1
Show InChI InChI=1S/C20H28N4O/c1-4-24(5-2)20(25)22-14-10-16-15-7-6-8-17-19(15)13(11-21-17)9-18(16)23(3)12-14/h6-8,11,14,16,18,21H,4-5,9-10,12H2,1-3H3,(H,22,25)/t14-,16+,18+/m0/s1
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n/an/a 69n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against Dopamine receptor D1 from homogenized rat brain, using [3H]SCH-23390 as the radioligand


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50017520
PNG
((+/-)-Dimethyl-(6,7,8,9-tetrahydro-3H-benzo[e]indo...)
Show SMILES CN(C)C1CCc2ccc3[nH]ccc3c2C1
Show InChI InChI=1S/C14H18N2/c1-16(2)11-5-3-10-4-6-14-12(7-8-15-14)13(10)9-11/h4,6-8,11,15H,3,5,9H2,1-2H3
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n/an/a 82n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against 5-hydroxytryptamine 1A receptor from homogenized rat brain, using [3H]8-OH-DPAT as the radioligand.


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50044235
PNG
(CHEMBL292274 | Dimethyl-(S)-6,7,8,9-tetrahydro-3H-...)
Show SMILES CN(C)[C@H]1CCc2ccc3[nH]ccc3c2C1
Show InChI InChI=1S/C14H18N2/c1-16(2)11-5-3-10-4-6-14-12(7-8-15-14)13(10)9-11/h4,6-8,11,15H,3,5,9H2,1-2H3/t11-/m0/s1
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n/an/a 244n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against 5-hydroxytryptamine 1A receptor from homogenized rat brain, using [3H]8-OH-DPAT as the radioligand.


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50044236
PNG
(CHEMBL303339 | Dimethyl-(R)-6,7,8,9-tetrahydro-3H-...)
Show SMILES CN(C)[C@@H]1CCc2ccc3[nH]ccc3c2C1
Show InChI InChI=1S/C14H18N2/c1-16(2)11-5-3-10-4-6-14-12(7-8-15-14)13(10)9-11/h4,6-8,11,15H,3,5,9H2,1-2H3/t11-/m1/s1
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n/an/a 1.05E+3n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against dopamine receptor D2 from homogenized rat brain, using [3H]spiperone as the radioligand.


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50017520
PNG
((+/-)-Dimethyl-(6,7,8,9-tetrahydro-3H-benzo[e]indo...)
Show SMILES CN(C)C1CCc2ccc3[nH]ccc3c2C1
Show InChI InChI=1S/C14H18N2/c1-16(2)11-5-3-10-4-6-14-12(7-8-15-14)13(10)9-11/h4,6-8,11,15H,3,5,9H2,1-2H3
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n/an/a 1.84E+3n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against dopamine receptor D2 from homogenized rat brain, using [3H]spiperone as the radioligand.


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM21393
PNG
(7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-o...)
Show SMILES CCCN(CCC)C1CCc2cccc(O)c2C1
Show InChI InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3
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n/an/a 5.76E+3n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against Dopamine receptor D2 from homogenized rat brain, using [3H]spiperone as the radioligand


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50044235
PNG
(CHEMBL292274 | Dimethyl-(S)-6,7,8,9-tetrahydro-3H-...)
Show SMILES CN(C)[C@H]1CCc2ccc3[nH]ccc3c2C1
Show InChI InChI=1S/C14H18N2/c1-16(2)11-5-3-10-4-6-14-12(7-8-15-14)13(10)9-11/h4,6-8,11,15H,3,5,9H2,1-2H3/t11-/m0/s1
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n/an/a 9.51E+3n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against dopamine receptor D2 from homogenized rat brain, using [3H]spiperone as the radioligand.


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50017520
PNG
((+/-)-Dimethyl-(6,7,8,9-tetrahydro-3H-benzo[e]indo...)
Show SMILES CN(C)C1CCc2ccc3[nH]ccc3c2C1
Show InChI InChI=1S/C14H18N2/c1-16(2)11-5-3-10-4-6-14-12(7-8-15-14)13(10)9-11/h4,6-8,11,15H,3,5,9H2,1-2H3
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n/an/a 1.97E+4n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against dopamine receptor D1 from homogenized rat brain, using [3H]SCH-23390 as the radioligand.


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50044236
PNG
(CHEMBL303339 | Dimethyl-(R)-6,7,8,9-tetrahydro-3H-...)
Show SMILES CN(C)[C@@H]1CCc2ccc3[nH]ccc3c2C1
Show InChI InChI=1S/C14H18N2/c1-16(2)11-5-3-10-4-6-14-12(7-8-15-14)13(10)9-11/h4,6-8,11,15H,3,5,9H2,1-2H3/t11-/m1/s1
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n/an/a 2.04E+4n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against dopamine receptor D1 from homogenized rat brain, using [3H]SCH-23390 as the radioligand.


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50044235
PNG
(CHEMBL292274 | Dimethyl-(S)-6,7,8,9-tetrahydro-3H-...)
Show SMILES CN(C)[C@H]1CCc2ccc3[nH]ccc3c2C1
Show InChI InChI=1S/C14H18N2/c1-16(2)11-5-3-10-4-6-14-12(7-8-15-14)13(10)9-11/h4,6-8,11,15H,3,5,9H2,1-2H3/t11-/m0/s1
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n/an/a 2.92E+4n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against dopamine receptor D1 from homogenized rat brain, using [3H]SCH-23390 as the radioligand.


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM21393
PNG
(7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-o...)
Show SMILES CCCN(CCC)C1CCc2cccc(O)c2C1
Show InChI InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of G£teborg

Curated by ChEMBL


Assay Description
In vitro binding activity against dopamine D1 receptor from homogenized rat brain, using [3H]SCH-23390 as the radioligand


J Med Chem 32: 2273-6 (1989)


BindingDB Entry DOI: 10.7270/Q2KD1ZG8
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%