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PubMed code 17713896

Compile data set for download or QSAR
Found 29 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
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50179260
PNG
(1-(3-(6-methoxynaphthalen-1-yl)propyl)-3,3-dimethy...)
Show SMILES COc1ccc2c(CCCN3CCCC(C)(C)C3)cccc2c1
Show InChI InChI=1S/C21H29NO/c1-21(2)12-6-14-22(16-21)13-5-9-17-7-4-8-18-15-19(23-3)10-11-20(17)18/h4,7-8,10-11,15H,5-6,9,12-14,16H2,1-3H3
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0.350n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50219753
PNG
(1-cyclohexyl-4-[3-(7-methoxynaphthalen-1-yl)propyl...)
Show SMILES COc1ccc2cccc(CCCN3CCN(CC3)C3CCCCC3)c2c1
Show InChI InChI=1S/C24H34N2O/c1-27-23-13-12-21-8-5-7-20(24(21)19-23)9-6-14-25-15-17-26(18-16-25)22-10-3-2-4-11-22/h5,7-8,12-13,19,22H,2-4,6,9-11,14-18H2,1H3
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0.900n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50145022
PNG
(1-Cyclohexyl-4-[3-(5-methoxy-naphthalen-1-yl)-prop...)
Show SMILES COc1cccc2c(CCCN3CCN(CC3)C3CCCCC3)cccc12
Show InChI InChI=1S/C24H34N2O/c1-27-24-14-6-12-22-20(8-5-13-23(22)24)9-7-15-25-16-18-26(19-17-25)21-10-3-2-4-11-21/h5-6,8,12-14,21H,2-4,7,9-11,15-19H2,1H3
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1.57n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50219751
PNG
(1-cyclohexyl-4-[3-(6-methoxynaphthalen-1-yl)propyl...)
Show SMILES COc1ccc2c(CCCN3CCN(CC3)C3CCCCC3)cccc2c1
Show InChI InChI=1S/C24H34N2O/c1-27-23-12-13-24-20(7-5-8-21(24)19-23)9-6-14-25-15-17-26(18-16-25)22-10-3-2-4-11-22/h5,7-8,12-13,19,22H,2-4,6,9-11,14-18H2,1H3
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3.16n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50035131
PNG
((+)-(6R,11S)-6,11-dimethyl-3-(3-methyl-but-2-enyl)...)
Show SMILES C[C@@H]1[C@@H]2Cc3ccc(O)cc3[C@@]1(C)CCN2CC=C(C)C
Show InChI InChI=1S/C19H27NO/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19/h5-7,12,14,18,21H,8-11H2,1-4H3/t14-,18+,19+/m1/s1
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3.24n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50219749
PNG
(3,3-dimethyl-1-[3-(7-methoxynaphthalen-1-yl)propyl...)
Show SMILES COc1ccc2cccc(CCCN3CCCC(C)(C)C3)c2c1
Show InChI InChI=1S/C21H29NO/c1-21(2)12-6-14-22(16-21)13-5-9-17-7-4-8-18-10-11-19(23-3)15-20(17)18/h4,7-8,10-11,15H,5-6,9,12-14,16H2,1-3H3
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4.12n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50145022
PNG
(1-Cyclohexyl-4-[3-(5-methoxy-naphthalen-1-yl)-prop...)
Show SMILES COc1cccc2c(CCCN3CCN(CC3)C3CCCCC3)cccc12
Show InChI InChI=1S/C24H34N2O/c1-27-24-14-6-12-22-20(8-5-13-23(22)24)9-7-15-25-16-18-26(19-17-25)21-10-3-2-4-11-21/h5-6,8,12-14,21H,2-4,7,9-11,15-19H2,1H3
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4.51n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50219755
PNG
(1-cyclohexyl-4-[3-(7-hydroxynaphthalen-1-yl)propyl...)
Show SMILES Oc1ccc2cccc(CCCN3CCN(CC3)C3CCCCC3)c2c1
Show InChI InChI=1S/C23H32N2O/c26-22-12-11-20-7-4-6-19(23(20)18-22)8-5-13-24-14-16-25(17-15-24)21-9-2-1-3-10-21/h4,6-7,11-12,18,21,26H,1-3,5,8-10,13-17H2
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5.48n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50219750
PNG
(1-cyclohexyl-4-[3-(6-hydroxynaphthalen-1-yl)propyl...)
Show SMILES Oc1ccc2c(CCCN3CCN(CC3)C3CCCCC3)cccc2c1
Show InChI InChI=1S/C23H32N2O/c26-22-11-12-23-19(6-4-7-20(23)18-22)8-5-13-24-14-16-25(17-15-24)21-9-2-1-3-10-21/h4,6-7,11-12,18,21,26H,1-3,5,8-10,13-17H2
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6.78n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50219751
PNG
(1-cyclohexyl-4-[3-(6-methoxynaphthalen-1-yl)propyl...)
Show SMILES COc1ccc2c(CCCN3CCN(CC3)C3CCCCC3)cccc2c1
Show InChI InChI=1S/C24H34N2O/c1-27-23-12-13-24-20(7-5-8-21(24)19-23)9-6-14-25-15-17-26(18-16-25)22-10-3-2-4-11-22/h5,7-8,12-13,19,22H,2-4,6,9-11,14-18H2,1H3
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7.06n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50219747
PNG
(3,3-dimethyl-1-[3-(5-methoxynaphthalen-1-yl)propyl...)
Show SMILES COc1cccc2c(CCCN3CCCC(C)(C)C3)cccc12
Show InChI InChI=1S/C21H29NO/c1-21(2)13-7-15-22(16-21)14-6-9-17-8-4-11-19-18(17)10-5-12-20(19)23-3/h4-5,8,10-12H,6-7,9,13-16H2,1-3H3
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12.8n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50007674
PNG
((+)-erythro 4-[2-(4-Benzyl-piperidin-1-yl)-1-hydro...)
Show SMILES C[C@@H]([C@H](O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H27NO2/c1-16(21(24)19-7-9-20(23)10-8-19)22-13-11-18(12-14-22)15-17-5-3-2-4-6-17/h2-10,16,18,21,23-24H,11-15H2,1H3/t16-,21-/m0/s1
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20n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50219750
PNG
(1-cyclohexyl-4-[3-(6-hydroxynaphthalen-1-yl)propyl...)
Show SMILES Oc1ccc2c(CCCN3CCN(CC3)C3CCCCC3)cccc2c1
Show InChI InChI=1S/C23H32N2O/c26-22-11-12-23-19(6-4-7-20(23)18-22)8-5-13-24-14-16-25(17-15-24)21-9-2-1-3-10-21/h4,6-7,11-12,18,21,26H,1-3,5,8-10,13-17H2
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21.3n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50219748
PNG
(3,3-dimethyl-1-[5-(9H-carbazol-9-yl)pentyl]piperid...)
Show SMILES CC1(C)CCCN(CCCCCn2c3ccccc3c3ccccc23)C1
Show InChI InChI=1S/C24H32N2/c1-24(2)15-10-17-25(19-24)16-8-3-9-18-26-22-13-6-4-11-20(22)21-12-5-7-14-23(21)26/h4-7,11-14H,3,8-10,15-19H2,1-2H3
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24n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50219757
PNG
(3,3-dimethyl-1-[3-(7-hydroxynaphthalen-1-yl)propyl...)
Show SMILES CC1(C)CCCN(CCCc2cccc3ccc(O)cc23)C1
Show InChI InChI=1S/C20H27NO/c1-20(2)11-5-13-21(15-20)12-4-8-16-6-3-7-17-9-10-18(22)14-19(16)17/h3,6-7,9-10,14,22H,4-5,8,11-13,15H2,1-2H3
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30n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50219753
PNG
(1-cyclohexyl-4-[3-(7-methoxynaphthalen-1-yl)propyl...)
Show SMILES COc1ccc2cccc(CCCN3CCN(CC3)C3CCCCC3)c2c1
Show InChI InChI=1S/C24H34N2O/c1-27-23-13-12-21-8-5-7-20(24(21)19-23)9-6-14-25-15-17-26(18-16-25)22-10-3-2-4-11-22/h5,7-8,12-13,19,22H,2-4,6,9-11,14-18H2,1H3
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42.4n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50219747
PNG
(3,3-dimethyl-1-[3-(5-methoxynaphthalen-1-yl)propyl...)
Show SMILES COc1cccc2c(CCCN3CCCC(C)(C)C3)cccc12
Show InChI InChI=1S/C21H29NO/c1-21(2)13-7-15-22(16-21)14-6-9-17-8-4-11-19-18(17)10-5-12-20(19)23-3/h4-5,8,10-12H,6-7,9,13-16H2,1-3H3
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44.9n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50219755
PNG
(1-cyclohexyl-4-[3-(7-hydroxynaphthalen-1-yl)propyl...)
Show SMILES Oc1ccc2cccc(CCCN3CCN(CC3)C3CCCCC3)c2c1
Show InChI InChI=1S/C23H32N2O/c26-22-12-11-20-7-4-6-19(23(20)18-22)8-5-13-24-14-16-25(17-15-24)21-9-2-1-3-10-21/h4,6-7,11-12,18,21,26H,1-3,5,8-10,13-17H2
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55n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50219754
PNG
(1-cyclohexyl-4-[3-(9H-carbazol-9-yl)propyl]piperaz...)
Show SMILES C(CN1CCN(CC1)C1CCCCC1)Cn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C25H33N3/c1-2-9-21(10-3-1)27-19-17-26(18-20-27)15-8-16-28-24-13-6-4-11-22(24)23-12-5-7-14-25(23)28/h4-7,11-14,21H,1-3,8-10,15-20H2
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79.9n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50219749
PNG
(3,3-dimethyl-1-[3-(7-methoxynaphthalen-1-yl)propyl...)
Show SMILES COc1ccc2cccc(CCCN3CCCC(C)(C)C3)c2c1
Show InChI InChI=1S/C21H29NO/c1-21(2)12-6-14-22(16-21)13-5-9-17-7-4-8-18-10-11-19(23-3)15-20(17)18/h4,7-8,10-11,15H,5-6,9,12-14,16H2,1-3H3
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115n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50219748
PNG
(3,3-dimethyl-1-[5-(9H-carbazol-9-yl)pentyl]piperid...)
Show SMILES CC1(C)CCCN(CCCCCn2c3ccccc3c3ccccc23)C1
Show InChI InChI=1S/C24H32N2/c1-24(2)15-10-17-25(19-24)16-8-3-9-18-26-22-13-6-4-11-20(22)21-12-5-7-14-23(21)26/h4-7,11-14H,3,8-10,15-19H2,1-2H3
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PubMed
138n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50219745
PNG
(3,3-dimethyl-1-[4-(9H-carbazol-9-yl)butyl]piperidi...)
Show SMILES CC1(C)CCCN(CCCCn2c3ccccc3c3ccccc23)C1
Show InChI InChI=1S/C23H30N2/c1-23(2)14-9-16-24(18-23)15-7-8-17-25-21-12-5-3-10-19(21)20-11-4-6-13-22(20)25/h3-6,10-13H,7-9,14-18H2,1-2H3
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175n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50219745
PNG
(3,3-dimethyl-1-[4-(9H-carbazol-9-yl)butyl]piperidi...)
Show SMILES CC1(C)CCCN(CCCCn2c3ccccc3c3ccccc23)C1
Show InChI InChI=1S/C23H30N2/c1-23(2)14-9-16-24(18-23)15-7-8-17-25-21-12-5-3-10-19(21)20-11-4-6-13-22(20)25/h3-6,10-13H,7-9,14-18H2,1-2H3
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270n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50219746
PNG
(3,3-dimethyl-1-[3-(6-hydroxynaphthalen-1-yl)propyl...)
Show SMILES CC1(C)CCCN(CCCc2cccc3cc(O)ccc23)C1
Show InChI InChI=1S/C20H27NO/c1-20(2)11-5-13-21(15-20)12-4-8-16-6-3-7-17-14-18(22)9-10-19(16)17/h3,6-7,9-10,14,22H,4-5,8,11-13,15H2,1-2H3
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340n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50219752
PNG
(3,3-dimethyl-1-[3-(9H-carbazol-9-yl)propyl]piperid...)
Show SMILES CC1(C)CCCN(CCCn2c3ccccc3c3ccccc23)C1
Show InChI InChI=1S/C22H28N2/c1-22(2)13-7-14-23(17-22)15-8-16-24-20-11-5-3-9-18(20)19-10-4-6-12-21(19)24/h3-6,9-12H,7-8,13-17H2,1-2H3
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345n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
3-beta-hydroxysteroid-delta(8),delta(7)-isomerase


(Cavia porcellus)
BDBM50219746
PNG
(3,3-dimethyl-1-[3-(6-hydroxynaphthalen-1-yl)propyl...)
Show SMILES CC1(C)CCCN(CCCc2cccc3cc(O)ccc23)C1
Show InChI InChI=1S/C20H27NO/c1-20(2)11-5-13-21(15-20)12-4-8-16-6-3-7-17-14-18(22)9-10-19(16)17/h3,6-7,9-10,14,22H,4-5,8,11-13,15H2,1-2H3
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352n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]emopamil from Delta-(8)-Delta-(7) sterol isomerase in guinea pig liver membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50219757
PNG
(3,3-dimethyl-1-[3-(7-hydroxynaphthalen-1-yl)propyl...)
Show SMILES CC1(C)CCCN(CCCc2cccc3ccc(O)cc23)C1
Show InChI InChI=1S/C20H27NO/c1-20(2)11-5-13-21(15-20)12-4-8-16-6-3-7-17-9-10-18(22)14-19(16)17/h3,6-7,9-10,14,22H,4-5,8,11-13,15H2,1-2H3
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733n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50219752
PNG
(3,3-dimethyl-1-[3-(9H-carbazol-9-yl)propyl]piperid...)
Show SMILES CC1(C)CCCN(CCCn2c3ccccc3c3ccccc23)C1
Show InChI InChI=1S/C22H28N2/c1-22(2)13-7-14-23(17-22)15-8-16-24-20-11-5-3-9-18(20)19-10-4-6-12-21(19)24/h3-6,9-12H,7-8,13-17H2,1-2H3
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PubMed
2.02E+3n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
Sigma-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50219754
PNG
(1-cyclohexyl-4-[3-(9H-carbazol-9-yl)propyl]piperaz...)
Show SMILES C(CN1CCN(CC1)C1CCCCC1)Cn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C25H33N3/c1-2-9-21(10-3-1)27-19-17-26(18-20-27)15-8-16-28-24-13-6-4-11-22(24)23-12-5-7-14-25(23)28/h4-7,11-14,21H,1-3,8-10,15-20H2
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PubMed
3.45E+3n/an/an/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]pentazocine from Sigma1 receptor in guinea pig brain membrane


J Med Chem 50: 4648-55 (2007)


Article DOI: 10.1021/jm070373b
BindingDB Entry DOI: 10.7270/Q2SQ917Z
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%