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PubMed code 8182701

Compile data set for download or QSAR
Found 39 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
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM22032
PNG
(1-(2-chlorophenyl)-N-methyl-N-(1-methylpropyl)isoq...)
Show SMILES CCC(C)N(C)C(=O)c1cc2ccccc2c(n1)-c1ccccc1Cl
Show InChI InChI=1S/C21H21ClN2O/c1-4-14(2)24(3)21(25)19-13-15-9-5-6-10-16(15)20(23-19)17-11-7-8-12-18(17)22/h5-14H,4H2,1-3H3
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n/an/a 2n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041483
PNG
(Acetic acid 7-chloro-5-phenyl-6-thia-10b-aza-benzo...)
Show SMILES CC(=O)OC1=C(Sc2c(Cl)cccc2-n2cccc12)c1ccccc1
Show InChI InChI=1S/C20H14ClNO2S/c1-13(23)24-18-16-11-6-12-22(16)17-10-5-9-15(21)20(17)25-19(18)14-7-3-2-4-8-14/h2-12H,1H3
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n/an/a 8n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50029750
PNG
(CHEMBL288551 | Dimethyl-carbamic acid 5-phenyl-6-t...)
Show SMILES CN(C)C(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccccc1
Show InChI InChI=1S/C21H18N2O2S/c1-22(2)21(24)25-19-17-12-8-14-23(17)16-11-6-7-13-18(16)26-20(19)15-9-4-3-5-10-15/h3-14H,1-2H3
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n/an/a 9n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041505
PNG
(CHEMBL33096 | Dimethyl-carbamic acid 5-(4-methoxy-...)
Show SMILES COc1ccc(cc1)C1=C(OC(=O)N(C)C)c2cccn2-c2ccccc2S1
Show InChI InChI=1S/C22H20N2O3S/c1-23(2)22(25)27-20-18-8-6-14-24(18)17-7-4-5-9-19(17)28-21(20)15-10-12-16(26-3)13-11-15/h4-14H,1-3H3
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n/an/a 9n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041493
PNG
(Acetic acid 5-phenyl-6-thia-10b-aza-benzo[e]azulen...)
Show SMILES CC(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccccc1
Show InChI InChI=1S/C20H15NO2S/c1-14(22)23-19-17-11-7-13-21(17)16-10-5-6-12-18(16)24-20(19)15-8-3-2-4-9-15/h2-13H,1H3
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n/an/a 20n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041506
PNG
(Acetic acid 7-chloro-5-(4-methoxy-phenyl)-6-thia-1...)
Show SMILES COc1ccc(cc1)C1=C(OC(C)=O)c2cccn2-c2cccc(Cl)c2S1
Show InChI InChI=1S/C21H16ClNO3S/c1-13(24)26-19-17-7-4-12-23(17)18-6-3-5-16(22)21(18)27-20(19)14-8-10-15(25-2)11-9-14/h3-12H,1-2H3
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Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041504
PNG
(Butyric acid 5-phenyl-6-thia-10b-aza-benzo[e]azule...)
Show SMILES CCCC(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccccc1
Show InChI InChI=1S/C22H19NO2S/c1-2-9-20(24)25-21-18-13-8-15-23(18)17-12-6-7-14-19(17)26-22(21)16-10-4-3-5-11-16/h3-8,10-15H,2,9H2,1H3
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n/an/a 22n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041513
PNG
(CHEMBL416214 | Hexanoic acid 5-phenyl-6-thia-10b-a...)
Show SMILES CCCCCC(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccccc1
Show InChI InChI=1S/C24H23NO2S/c1-2-3-5-16-22(26)27-23-20-14-10-17-25(20)19-13-8-9-15-21(19)28-24(23)18-11-6-4-7-12-18/h4,6-15,17H,2-3,5,16H2,1H3
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n/an/a 23n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041496
PNG
(Butyric acid 5-(4-methoxy-phenyl)-6-thia-10b-aza-b...)
Show SMILES CCCC(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccc(OC)cc1
Show InChI InChI=1S/C23H21NO3S/c1-3-7-21(25)27-22-19-9-6-15-24(19)18-8-4-5-10-20(18)28-23(22)16-11-13-17(26-2)14-12-16/h4-6,8-15H,3,7H2,1-2H3
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n/an/a 28n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041479
PNG
(CHEMBL32716 | Propionic acid 5-(4-methoxy-phenyl)-...)
Show SMILES CCC(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccc(OC)cc1
Show InChI InChI=1S/C22H19NO3S/c1-3-20(24)26-21-18-8-6-14-23(18)17-7-4-5-9-19(17)27-22(21)15-10-12-16(25-2)13-11-15/h4-14H,3H2,1-2H3
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n/an/a 30n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041502
PNG
(Acetic acid 5-(4-methoxy-phenyl)-6-thia-10b-aza-be...)
Show SMILES COc1ccc(cc1)C1=C(OC(C)=O)c2cccn2-c2ccccc2S1
Show InChI InChI=1S/C21H17NO3S/c1-14(23)25-20-18-7-5-13-22(18)17-6-3-4-8-19(17)26-21(20)15-9-11-16(24-2)12-10-15/h3-13H,1-2H3
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n/an/a 34n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041508
PNG
(CHEMBL416040 | Pentanoic acid 5-phenyl-6-thia-10b-...)
Show SMILES CCCCC(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccccc1
Show InChI InChI=1S/C23H21NO2S/c1-2-3-15-21(25)26-22-19-13-9-16-24(19)18-12-7-8-14-20(18)27-23(22)17-10-5-4-6-11-17/h4-14,16H,2-3,15H2,1H3
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n/an/a 48n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM22040
PNG
(4 -chlorodiazepam | 4' Cl-diazepam | 7-chloro-...)
Show SMILES CN1c2ccc(Cl)cc2C(=NCC1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H12Cl2N2O/c1-20-14-7-6-12(18)8-13(14)16(19-9-15(20)21)10-2-4-11(17)5-3-10/h2-8H,9H2,1H3
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n/an/a 58n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041501
PNG
(CHEMBL34048 | Methanesulfonic acid 5-phenyl-6-thia...)
Show SMILES CS(=O)(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccccc1
Show InChI InChI=1S/C19H15NO3S2/c1-25(21,22)23-18-16-11-7-13-20(16)15-10-5-6-12-17(15)24-19(18)14-8-3-2-4-9-14/h2-13H,1H3
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n/an/a 60n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041503
PNG
(CHEMBL32254 | Propionic acid 5-phenyl-6-thia-10b-a...)
Show SMILES CCC(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccccc1
Show InChI InChI=1S/C21H17NO2S/c1-2-19(23)24-20-17-12-8-14-22(17)16-11-6-7-13-18(16)25-21(20)15-9-4-3-5-10-15/h3-14H,2H2,1H3
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n/an/a 67n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50029754
PNG
(CHEMBL286909 | Methanesulfonic acid 5-(4-methoxy-p...)
Show SMILES COc1ccc(cc1)C1=C(OS(C)(=O)=O)c2cccn2-c2ccccc2S1
Show InChI InChI=1S/C20H17NO4S2/c1-24-15-11-9-14(10-12-15)20-19(25-27(2,22)23)17-7-5-13-21(17)16-6-3-4-8-18(16)26-20/h3-13H,1-2H3
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n/an/a 95n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041481
PNG
(CHEMBL33999 | Dimethyl-carbamic acid 9-chloro-5-(4...)
Show SMILES COc1ccc(cc1)C1=C(OC(=O)N(C)C)c2cccn2-c2cc(Cl)ccc2S1
Show InChI InChI=1S/C22H19ClN2O3S/c1-24(2)22(26)28-20-17-5-4-12-25(17)18-13-15(23)8-11-19(18)29-21(20)14-6-9-16(27-3)10-7-14/h4-13H,1-3H3
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n/an/a 170n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041507
PNG
(Acetic acid 8-chloro-5-phenyl-6-thia-10b-aza-benzo...)
Show SMILES CC(=O)OC1=C(Sc2cc(Cl)ccc2-n2cccc12)c1ccccc1
Show InChI InChI=1S/C20H14ClNO2S/c1-13(23)24-19-17-8-5-11-22(17)16-10-9-15(21)12-18(16)25-20(19)14-6-3-2-4-7-14/h2-12H,1H3
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n/an/a 230n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041491
PNG
(Acetic acid 8-chloro-5-(4-methoxy-phenyl)-6-thia-1...)
Show SMILES COc1ccc(cc1)C1=C(OC(C)=O)c2cccn2-c2ccc(Cl)cc2S1
Show InChI InChI=1S/C21H16ClNO3S/c1-13(24)26-20-18-4-3-11-23(18)17-10-7-15(22)12-19(17)27-21(20)14-5-8-16(25-2)9-6-14/h3-12H,1-2H3
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n/an/a 240n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041509
PNG
(Butyric acid 5-(4-methoxy-phenyl)-6-oxo-6H-6lambda...)
Show SMILES CCCC(=O)OC1=C(c2ccc(OC)cc2)S(=O)c2ccccc2-n2cccc12
Show InChI InChI=1S/C23H21NO4S/c1-3-7-21(25)28-22-19-9-6-15-24(19)18-8-4-5-10-20(18)29(26)23(22)16-11-13-17(27-2)14-12-16/h4-6,8-15H,3,7H2,1-2H3
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n/an/a 270n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041494
PNG
(CHEMBL33641 | Dimethyl-carbamic acid 5-(4-methoxy-...)
Show SMILES COc1ccc(cc1)C1=C(OC(=O)N(C)C)c2cccn2-c2cc(ccc2S1)C(F)(F)F
Show InChI InChI=1S/C23H19F3N2O3S/c1-27(2)22(29)31-20-17-5-4-12-28(17)18-13-15(23(24,25)26)8-11-19(18)32-21(20)14-6-9-16(30-3)10-7-14/h4-13H,1-3H3
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n/an/a 290n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041480
PNG
(CHEMBL286381 | Propionic acid 9-chloro-5-(4-methox...)
Show SMILES CCC(=O)OC1=C(Sc2ccc(Cl)cc2-n2cccc12)c1ccc(OC)cc1
Show InChI InChI=1S/C22H18ClNO3S/c1-3-20(25)27-21-17-5-4-12-24(17)18-13-15(23)8-11-19(18)28-22(21)14-6-9-16(26-2)10-7-14/h4-13H,3H2,1-2H3
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n/an/a 490n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041485
PNG
(Acetic acid 9-chloro-5-phenyl-6-thia-10b-aza-benzo...)
Show SMILES CC(=O)OC1=C(Sc2ccc(Cl)cc2-n2cccc12)c1ccccc1
Show InChI InChI=1S/C20H14ClNO2S/c1-13(23)24-19-16-8-5-11-22(16)17-12-15(21)9-10-18(17)25-20(19)14-6-3-2-4-7-14/h2-12H,1H3
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n/an/a 560n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041488
PNG
(Acetic acid 5-(4-methoxy-phenyl)-6,6-dioxo-6H-6lam...)
Show SMILES COc1ccc(cc1)C1=C(OC(C)=O)c2cccn2-c2ccccc2S1(=O)=O
Show InChI InChI=1S/C21H17NO5S/c1-14(23)27-20-18-7-5-13-22(18)17-6-3-4-8-19(17)28(24,25)21(20)15-9-11-16(26-2)12-10-15/h3-13H,1-2H3
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n/an/a 640n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041490
PNG
(Acetic acid 9-chloro-5-(4-methoxy-phenyl)-6-thia-1...)
Show SMILES COc1ccc(cc1)C1=C(OC(C)=O)c2cccn2-c2cc(Cl)ccc2S1
Show InChI InChI=1S/C21H16ClNO3S/c1-13(24)26-20-17-4-3-11-23(17)18-12-15(22)7-10-19(18)27-21(20)14-5-8-16(25-2)9-6-14/h3-12H,1-2H3
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n/an/a 650n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041489
PNG
(Acetic acid 6-oxo-5-phenyl-6H-6lambda*4*-thia-10b-...)
Show SMILES CC(=O)OC1=C(c2ccccc2)S(=O)c2ccccc2-n2cccc12
Show InChI InChI=1S/C20H15NO3S/c1-14(22)24-19-17-11-7-13-21(17)16-10-5-6-12-18(16)25(23)20(19)15-8-3-2-4-9-15/h2-13H,1H3
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n/an/a 690n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041487
PNG
(CHEMBL33619 | Propionic acid 9-chloro-5-phenyl-6-t...)
Show SMILES CCC(=O)OC1=C(Sc2ccc(Cl)cc2-n2cccc12)c1ccccc1
Show InChI InChI=1S/C21H16ClNO2S/c1-2-19(24)25-20-16-9-6-12-23(16)17-13-15(22)10-11-18(17)26-21(20)14-7-4-3-5-8-14/h3-13H,2H2,1H3
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n/an/a 820n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041511
PNG
(Acetic acid 6,6-dioxo-5-phenyl-6H-6lambda*6*-thia-...)
Show SMILES CC(=O)OC1=C(c2ccccc2)S(=O)(=O)c2ccccc2-n2cccc12
Show InChI InChI=1S/C20H15NO4S/c1-14(22)25-19-17-11-7-13-21(17)16-10-5-6-12-18(16)26(23,24)20(19)15-8-3-2-4-9-15/h2-13H,1H3
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n/an/a 1.14E+3n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041512
PNG
(5-Phenyl-6-thia-10b-aza-benzo[e]azulen-4-one | CHE...)
Show SMILES O=C1C(Sc2ccccc2-n2cccc12)c1ccccc1
Show InChI InChI=1S/C18H13NOS/c20-17-15-10-6-12-19(15)14-9-4-5-11-16(14)21-18(17)13-7-2-1-3-8-13/h1-12,18H
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n/an/a 1.22E+3n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041499
PNG
(9-Chloro-5-(4-methoxy-phenyl)-6-thia-10b-aza-benzo...)
Show SMILES COc1ccc(cc1)C1Sc2ccc(Cl)cc2-n2cccc2C1=O
Show InChI InChI=1S/C19H14ClNO2S/c1-23-14-7-4-12(5-8-14)19-18(22)15-3-2-10-21(15)16-11-13(20)6-9-17(16)24-19/h2-11,19H,1H3
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n/an/a 1.41E+3n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041482
PNG
(Acetic acid 9-methoxy-5-(4-methoxy-phenyl)-6-thia-...)
Show SMILES COc1ccc(cc1)C1=C(OC(C)=O)c2cccn2-c2cc(OC)ccc2S1
Show InChI InChI=1S/C22H19NO4S/c1-14(24)27-21-18-5-4-12-23(18)19-13-17(26-3)10-11-20(19)28-22(21)15-6-8-16(25-2)9-7-15/h4-13H,1-3H3
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n/an/a 1.81E+3n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041495
PNG
(Acetic acid 5-(4-methoxy-phenyl)-6-oxo-6H-6lambda*...)
Show SMILES COc1ccc(cc1)C1=C(OC(C)=O)c2cccn2-c2ccccc2S1=O
Show InChI InChI=1S/C21H17NO4S/c1-14(23)26-20-18-7-5-13-22(18)17-6-3-4-8-19(17)27(24)21(20)15-9-11-16(25-2)12-10-15/h3-13H,1-2H3
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n/an/a 2.09E+3n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041498
PNG
(5-(4-Methoxy-phenyl)-6-thia-10b-aza-benzo[e]azulen...)
Show SMILES COc1ccc(cc1)C1Sc2ccccc2-n2cccc2C1=O
Show InChI InChI=1S/C19H15NO2S/c1-22-14-10-8-13(9-11-14)19-18(21)16-6-4-12-20(16)15-5-2-3-7-17(15)23-19/h2-12,19H,1H3
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n/an/a 2.09E+3n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041510
PNG
(CHEMBL32765 | Propionic acid 5-(4-methoxy-phenyl)-...)
Show SMILES CCC(=O)OC1=C(Sc2ccc(cc2-n2cccc12)C(F)(F)F)c1ccc(OC)cc1
Show InChI InChI=1S/C23H18F3NO3S/c1-3-20(28)30-21-17-5-4-12-27(17)18-13-15(23(24,25)26)8-11-19(18)31-22(21)14-6-9-16(29-2)10-7-14/h4-13H,3H2,1-2H3
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n/an/a 2.95E+3n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041492
PNG
(Acetic acid 5-(4-methoxy-phenyl)-9-trifluoromethyl...)
Show SMILES COc1ccc(cc1)C1=C(OC(C)=O)c2cccn2-c2cc(ccc2S1)C(F)(F)F
Show InChI InChI=1S/C22H16F3NO3S/c1-13(27)29-20-17-4-3-11-26(17)18-12-15(22(23,24)25)7-10-19(18)30-21(20)14-5-8-16(28-2)9-6-14/h3-12H,1-2H3
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n/an/a 4.53E+3n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041500
PNG
(5-(4-Methoxy-phenyl)-9-trifluoromethyl-6-thia-10b-...)
Show SMILES COc1ccc(cc1)C1Sc2ccc(cc2-n2cccc2C1=O)C(F)(F)F
Show InChI InChI=1S/C20H14F3NO2S/c1-26-14-7-4-12(5-8-14)19-18(25)15-3-2-10-24(15)16-11-13(20(21,22)23)6-9-17(16)27-19/h2-11,19H,1H3
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n/an/a 6.21E+3n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041484
PNG
(6-Thia-10b-aza-benzo[e]azulen-4-one | CHEMBL286138)
Show SMILES O=C1CSc2ccccc2-n2cccc12
Show InChI InChI=1S/C12H9NOS/c14-11-8-15-12-6-2-1-4-10(12)13-7-3-5-9(11)13/h1-7H,8H2
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n/an/a 1.40E+4n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041486
PNG
(6-Oxo-5-phenyl-5,6-dihydro-6lambda*4*-thia-10b-aza...)
Show SMILES OS1=C(c2ccccc2)C(=O)c2cccn2-c2ccccc12
Show InChI InChI=1S/C18H13NO2S/c20-17-15-10-6-12-19(15)14-9-4-5-11-16(14)22(21)18(17)13-7-2-1-3-8-13/h1-12,21H
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n/an/a 1.47E+4n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50041497
PNG
(5-(4-Methoxy-phenyl)-6-oxo-5,6-dihydro-6lambda*4*-...)
Show SMILES COc1ccc(cc1)C1=S(O)c2ccccc2-n2cccc2C1=O
Show InChI InChI=1S/C19H15NO3S/c1-23-14-10-8-13(9-11-14)19-18(21)16-6-4-12-20(16)15-5-2-3-7-17(15)24(19)22/h2-12,22H,1H3
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n/an/a 2.00E+4n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK 11195 from peripheral (mitochondrial) benzodiazepine receptor


J Med Chem 37: 1427-38 (1994)


Article DOI: 10.1021/jm00036a007
BindingDB Entry DOI: 10.7270/Q2668DVR
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%