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Compile Data Set for Download or QSAR

Found 771 hits with Last Name = 'williams' and Initial = 'dc'   
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
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50113782
PNG
((10R,13S,17S)-17-hydroxy-13-methyl-10-(4-methylben...)
Show SMILES CC#C[C@]1(O)CCC2C3CCC4=CC(=O)CC[C@]4(Cc4ccc(C)cc4)C3=CC[C@]12C |c:29,t:11|
Show InChI InChI=1S/C29H34O2/c1-4-14-29(31)17-13-25-24-10-9-22-18-23(30)11-16-28(22,26(24)12-15-27(25,29)3)19-21-7-5-20(2)6-8-21/h5-8,12,18,24-25,31H,9-11,13,15-17,19H2,1-3H3/t24?,25?,27-,28+,29-/m0/s1
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0.100n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50113783
PNG
((2R,4aS,10aR)-4a-benzyl-2-(chloroethynyl)-1,2,3,4,...)
Show SMILES Oc1ccc2c(CC[C@@H]3C[C@](O)(CC[C@@]23Cc2ccccc2)C#CCl)c1
Show InChI InChI=1S/C23H23ClO2/c24-13-12-22(26)10-11-23(15-17-4-2-1-3-5-17)19(16-22)7-6-18-14-20(25)8-9-21(18)23/h1-5,8-9,14,19,25-26H,6-7,10-11,15-16H2/t19-,22+,23+/m1/s1
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0.100n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50113780
PNG
((2R,4aS,10aR)-4a-benzyl-2-(prop-1-ynyl)-1,2,3,4,4a...)
Show SMILES CC#C[C@@]1(O)CC[C@]2(Cc3ccccc3)[C@H](CCc3cc(O)ccc23)C1
Show InChI InChI=1S/C24H26O2/c1-2-12-23(26)13-14-24(16-18-6-4-3-5-7-18)20(17-23)9-8-19-15-21(25)10-11-22(19)24/h3-7,10-11,15,20,25-26H,8-9,13-14,16-17H2,1H3/t20-,23-,24+/m1/s1
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0.170n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM18627
PNG
((10S,11S,14S,15S,17R)-17-[4-(dimethylamino)phenyl]...)
Show SMILES [H][C@@]12CC[C@@](O)(C#CC)[C@@]1(C)C[C@@H](C1=C3CCC(=O)C=C3CC[C@@]21[H])c1ccc(cc1)N(C)C |r,c:14,20|
Show InChI InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17,24-26,32H,8,11-14,16,18H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1
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0.240n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Translocator protein


(Rattus norvegicus (rat))
BDBM50052754
PNG
(CHEMBL115740 | Diethyl-carbamic acid 5-phenyl-6-ox...)
Show SMILES CCN(CC)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:8|
Show InChI InChI=1S/C23H22N2O3/c1-3-24(4-2)23(26)28-22-19-14-10-16-25(19)18-13-8-9-15-20(18)27-21(22)17-11-6-5-7-12-17/h5-16H,3-4H2,1-2H3
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0.260n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052749
PNG
(CHEMBL325025 | Diethyl-carbamic acid 5-p-tolyl-6-o...)
Show SMILES CCN(CC)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc(C)cc1 |t:8|
Show InChI InChI=1S/C24H24N2O3/c1-4-25(5-2)24(27)29-23-20-10-8-16-26(20)19-9-6-7-11-21(19)28-22(23)18-14-12-17(3)13-15-18/h6-16H,4-5H2,1-3H3
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0.360n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052753
PNG
(CHEMBL325953 | Dimethyl-carbamic acid 7-chloro-5-p...)
Show SMILES CN(C)C(=O)OC1=C(Oc2c(Cl)cccc2-n2cccc12)c1ccccc1 |t:6|
Show InChI InChI=1S/C21H17ClN2O3/c1-23(2)21(25)27-20-17-12-7-13-24(17)16-11-6-10-15(22)19(16)26-18(20)14-8-4-3-5-9-14/h3-13H,1-2H3
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0.510n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052747
PNG
(CHEMBL117444 | Dimethyl-carbamic acid 5-p-tolyl-6-...)
Show SMILES CN(C)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc(C)cc1 |t:6|
Show InChI InChI=1S/C22H20N2O3/c1-15-10-12-16(13-11-15)20-21(27-22(25)23(2)3)18-8-6-14-24(18)17-7-4-5-9-19(17)26-20/h4-14H,1-3H3
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0.520n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(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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0.780n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Translocator protein


(Rattus norvegicus (rat))
BDBM50052751
PNG
(CHEMBL325169 | Dimethyl-carbamic acid 5-phenyl-6-o...)
Show SMILES CN(C)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:6|
Show InChI InChI=1S/C21H18N2O3/c1-22(2)21(24)26-20-17-12-8-14-23(17)16-11-6-7-13-18(16)25-19(20)15-9-4-3-5-10-15/h3-14H,1-2H3
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0.800n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-Ro- 5-4864 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052744
PNG
(Acetic acid 5-p-tolyl-6-oxa-10b-aza-benzo[e]azulen...)
Show SMILES CC(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc(C)cc1 |t:4|
Show InChI InChI=1S/C21H17NO3/c1-14-9-11-16(12-10-14)20-21(24-15(2)23)18-7-5-13-22(18)17-6-3-4-8-19(17)25-20/h3-13H,1-2H3
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0.910n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052751
PNG
(CHEMBL325169 | Dimethyl-carbamic acid 5-phenyl-6-o...)
Show SMILES CN(C)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:6|
Show InChI InChI=1S/C21H18N2O3/c1-22(2)21(24)26-20-17-12-8-14-23(17)16-11-6-7-13-18(16)25-19(20)15-9-4-3-5-10-15/h3-14H,1-2H3
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1n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement [3H]-PK 11195 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM18207
PNG
((1R,2S,10S,11S,13R,14R,15S,17S)-1-fluoro-14,17-dih...)
Show SMILES [H][C@@]12C[C@@H](C)[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C |c:28,t:24|
Show InChI InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1
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1.10n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Translocator protein


(Rattus norvegicus (rat))
BDBM50052747
PNG
(CHEMBL117444 | Dimethyl-carbamic acid 5-p-tolyl-6-...)
Show SMILES CN(C)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc(C)cc1 |t:6|
Show InChI InChI=1S/C22H20N2O3/c1-15-10-12-16(13-11-15)20-21(27-22(25)23(2)3)18-8-6-14-24(18)17-7-4-5-9-19(17)26-20/h4-14H,1-3H3
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1.10n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement [3H]-PK 11195 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052747
PNG
(CHEMBL117444 | Dimethyl-carbamic acid 5-p-tolyl-6-...)
Show SMILES CN(C)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc(C)cc1 |t:6|
Show InChI InChI=1S/C22H20N2O3/c1-15-10-12-16(13-11-15)20-21(27-22(25)23(2)3)18-8-6-14-24(18)17-7-4-5-9-19(17)26-20/h4-14H,1-3H3
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1.30n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-Ro- 5-4864 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052750
PNG
(CHEMBL115470 | Dimethyl-carbamic acid 5-(4-azido-p...)
Show SMILES CN(C)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc(cc1)N=[N+]=[N-] |t:6|
Show InChI InChI=1S/C21H17N5O3/c1-25(2)21(27)29-20-17-7-5-13-26(17)16-6-3-4-8-18(16)28-19(20)14-9-11-15(12-10-14)23-24-22/h3-13H,1-2H3
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1.40n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052757
PNG
(CHEMBL326302 | Diethyl-thiocarbamic acid 5-phenyl-...)
Show SMILES CCN(CC)C(=S)OC1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:8|
Show InChI InChI=1S/C23H22N2O2S/c1-3-24(4-2)23(28)27-22-19-14-10-16-25(19)18-13-8-9-15-20(18)26-21(22)17-11-6-5-7-12-17/h5-16H,3-4H2,1-2H3
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1.5n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052744
PNG
(Acetic acid 5-p-tolyl-6-oxa-10b-aza-benzo[e]azulen...)
Show SMILES CC(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc(C)cc1 |t:4|
Show InChI InChI=1S/C21H17NO3/c1-14-9-11-16(12-10-14)20-21(24-15(2)23)18-7-5-13-22(18)17-6-3-4-8-19(17)25-20/h3-13H,1-2H3
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1.70n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-Ro- 5-4864 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50038256
PNG
(CHEMBL117589 | Dimethyl-carbamic acid 7-chloro-5-p...)
Show SMILES CN(C)C(=O)OC1=C(Sc2c(Cl)cccc2-n2cccc12)c1ccccc1 |t:6|
Show InChI InChI=1S/C21H17ClN2O2S/c1-23(2)21(25)26-18-16-12-7-13-24(16)17-11-6-10-15(22)20(17)27-19(18)14-8-4-3-5-9-14/h3-13H,1-2H3
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1.80n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052741
PNG
(CHEMBL325649 | Dimethyl-carbamic acid 5-naphthalen...)
Show SMILES CN(C)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc2ccccc2c1 |t:6|
Show InChI InChI=1S/C25H20N2O3/c1-26(2)25(28)30-24-21-11-7-15-27(21)20-10-5-6-12-22(20)29-23(24)19-14-13-17-8-3-4-9-18(17)16-19/h3-16H,1-2H3
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1.80n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-Ro- 5-4864 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052749
PNG
(CHEMBL325025 | Diethyl-carbamic acid 5-p-tolyl-6-o...)
Show SMILES CCN(CC)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc(C)cc1 |t:8|
Show InChI InChI=1S/C24H24N2O3/c1-4-25(5-2)24(27)29-23-20-10-8-16-26(20)19-9-6-7-11-21(19)28-22(23)18-14-12-17(3)13-15-18/h6-16H,4-5H2,1-3H3
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1.90n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement [3H]-PK 11195 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052749
PNG
(CHEMBL325025 | Diethyl-carbamic acid 5-p-tolyl-6-o...)
Show SMILES CCN(CC)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc(C)cc1 |t:8|
Show InChI InChI=1S/C24H24N2O3/c1-4-25(5-2)24(27)29-23-20-10-8-16-26(20)19-9-6-7-11-21(19)28-22(23)18-14-12-17(3)13-15-18/h6-16H,4-5H2,1-3H3
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1.90n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-Ro- 5-4864 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052741
PNG
(CHEMBL325649 | Dimethyl-carbamic acid 5-naphthalen...)
Show SMILES CN(C)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc2ccccc2c1 |t:6|
Show InChI InChI=1S/C25H20N2O3/c1-26(2)25(28)30-24-21-11-7-15-27(21)20-10-5-6-12-22(20)29-23(24)19-14-13-17-8-3-4-9-18(17)16-19/h3-16H,1-2H3
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1.90n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement [3H]-PK 11195 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052751
PNG
(CHEMBL325169 | Dimethyl-carbamic acid 5-phenyl-6-o...)
Show SMILES CN(C)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:6|
Show InChI InChI=1S/C21H18N2O3/c1-22(2)21(24)26-20-17-12-8-14-23(17)16-11-6-7-13-18(16)25-19(20)15-9-4-3-5-10-15/h3-14H,1-2H3
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2n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50315763
PNG
((4bS,7R,8aR)-4b-benzyl-7-hydroxy-7-(prop-1-ynyl)-N...)
Show SMILES CC#C[C@@]1(O)CC[C@]2(Cc3ccccc3)[C@H](CCc3cc(ccc23)C(=O)NCc2ccncc2)C1 |r|
Show InChI InChI=1S/C31H32N2O2/c1-2-14-30(35)15-16-31(20-23-6-4-3-5-7-23)27(21-30)10-8-25-19-26(9-11-28(25)31)29(34)33-22-24-12-17-32-18-13-24/h3-7,9,11-13,17-19,27,35H,8,10,15-16,20-22H2,1H3,(H,33,34)/t27-,30-,31+/m1/s1
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2n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052741
PNG
(CHEMBL325649 | Dimethyl-carbamic acid 5-naphthalen...)
Show SMILES CN(C)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc2ccccc2c1 |t:6|
Show InChI InChI=1S/C25H20N2O3/c1-26(2)25(28)30-24-21-11-7-15-27(21)20-10-5-6-12-22(20)29-23(24)19-14-13-17-8-3-4-9-18(17)16-19/h3-16H,1-2H3
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2.40n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM19190
PNG
((1S,2R,10S,11S,14R,15S,17S)-14,17-dihydroxy-14-(2-...)
Show SMILES [H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)C=C[C@]12C |r,c:27,t:23|
Show InChI InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1
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2.40n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50038256
PNG
(CHEMBL117589 | Dimethyl-carbamic acid 7-chloro-5-p...)
Show SMILES CN(C)C(=O)OC1=C(Sc2c(Cl)cccc2-n2cccc12)c1ccccc1 |t:6|
Show InChI InChI=1S/C21H17ClN2O2S/c1-23(2)21(25)26-18-16-12-7-13-24(16)17-11-6-10-15(22)20(17)27-19(18)14-8-4-3-5-9-14/h3-13H,1-2H3
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2.5n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement [3H]-PK 11195 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50038256
PNG
(CHEMBL117589 | Dimethyl-carbamic acid 7-chloro-5-p...)
Show SMILES CN(C)C(=O)OC1=C(Sc2c(Cl)cccc2-n2cccc12)c1ccccc1 |t:6|
Show InChI InChI=1S/C21H17ClN2O2S/c1-23(2)21(25)26-18-16-12-7-13-24(16)17-11-6-10-15(22)20(17)27-19(18)14-8-4-3-5-9-14/h3-13H,1-2H3
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2.60n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-Ro- 5-4864 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50124614
PNG
(5-Allyl-10-methoxy-2,2,4-trimethyl-2,5-dihydro-1H-...)
Show SMILES COC(=O)c1ccc2OC(CC=C)c3c(ccc4NC(C)(C)C=C(C)c34)-c2c1OC |t:22|
Show InChI InChI=1S/C25H27NO4/c1-7-8-18-21-15(9-11-17-20(21)14(2)13-25(3,4)26-17)22-19(30-18)12-10-16(23(22)28-5)24(27)29-6/h7,9-13,18,26H,1,8H2,2-6H3
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2.80n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052744
PNG
(Acetic acid 5-p-tolyl-6-oxa-10b-aza-benzo[e]azulen...)
Show SMILES CC(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc(C)cc1 |t:4|
Show InChI InChI=1S/C21H17NO3/c1-14-9-11-16(12-10-14)20-21(24-15(2)23)18-7-5-13-22(18)17-6-3-4-8-19(17)25-20/h3-13H,1-2H3
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2.80n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement [3H]-PK 11195 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50029750
PNG
(CHEMBL288551 | Dimethyl-carbamic acid 5-phenyl-6-t...)
Show SMILES CN(C)C(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccccc1 |t:6|
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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3.5n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052750
PNG
(CHEMBL115470 | Dimethyl-carbamic acid 5-(4-azido-p...)
Show SMILES CN(C)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc(cc1)N=[N+]=[N-] |t:6|
Show InChI InChI=1S/C21H17N5O3/c1-25(2)21(27)29-20-17-7-5-13-26(17)16-6-3-4-8-18(16)28-19(20)14-9-11-15(12-10-14)23-24-22/h3-13H,1-2H3
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3.60n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-Ro- 5-4864 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50315767
PNG
((S)-5-allyl-9-(ethynyloxy)-10-methoxy-2,2,4-trimet...)
Show SMILES COc1c(OC#C)ccc2O[C@@H](CC=C)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |r,t:24|
Show InChI InChI=1S/C25H25NO3/c1-7-9-18-22-16(10-11-17-21(22)15(3)14-25(4,5)26-17)23-19(29-18)12-13-20(28-8-2)24(23)27-6/h2,7,10-14,18,26H,1,9H2,3-6H3/t18-/m0/s1
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4.20n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052748
PNG
(Acetic acid 5-phenyl-6-oxa-10b-aza-benzo[e]azulen-...)
Show SMILES CC(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:4|
Show InChI InChI=1S/C20H15NO3/c1-14(22)23-20-17-11-7-13-21(17)16-10-5-6-12-18(16)24-19(20)15-8-3-2-4-9-15/h2-13H,1H3
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4.70n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052750
PNG
(CHEMBL115470 | Dimethyl-carbamic acid 5-(4-azido-p...)
Show SMILES CN(C)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc(cc1)N=[N+]=[N-] |t:6|
Show InChI InChI=1S/C21H17N5O3/c1-25(2)21(27)29-20-17-7-5-13-26(17)16-6-3-4-8-18(16)28-19(20)14-9-11-15(12-10-14)23-24-22/h3-13H,1-2H3
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4.80n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Displacement [3H]-PK 11195 from rat adrenal peripheral-type benzodiazepine receptor (PBR)


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50113777
PNG
((4aS,10aR)-4a-benzyl-7-hydroxy-3,4,4a,9,10,10a-hex...)
Show SMILES Oc1ccc2c(CC[C@@H]3CC(=O)CC[C@@]23Cc2ccccc2)c1
Show InChI InChI=1S/C21H22O2/c22-18-8-9-20-16(12-18)6-7-17-13-19(23)10-11-21(17,20)14-15-4-2-1-3-5-15/h1-5,8-9,12,17,22H,6-7,10-11,13-14H2/t17-,21+/m1/s1
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6n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50315765
PNG
((S)-5-allyl-10-ethynyl-2,2,4-trimethyl-2,5-dihydro...)
Show SMILES CC1=CC(C)(C)Nc2ccc-3c([C@H](CC=C)Oc4cccc(C#C)c-34)c12 |r,t:1|
Show InChI InChI=1S/C24H23NO/c1-6-9-19-23-17(22-16(7-2)10-8-11-20(22)26-19)12-13-18-21(23)15(3)14-24(4,5)25-18/h2,6,8,10-14,19,25H,1,9H2,3-5H3/t19-/m0/s1
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6.90n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
Translocator protein


(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 |t:4|
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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7.60n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50029755
PNG
(Acetic acid 5-(4-chloro-phenyl)-6-thia-10b-aza-ben...)
Show SMILES CC(=O)OC1=C(Sc2ccccc2-n2cccc12)c1ccc(Cl)cc1 |t:4|
Show InChI InChI=1S/C20H14ClNO2S/c1-13(23)24-19-17-6-4-12-22(17)16-5-2-3-7-18(16)25-20(19)14-8-10-15(21)11-9-14/h2-12H,1H3
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12n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052745
PNG
(CHEMBL114508 | Dimethyl-carbamic acid 5-phenyl-6-o...)
Show SMILES CN(C)C(=O)OC1=C(Oc2cc3ccccc3cc2-n2cccc12)c1ccccc1 |t:6|
Show InChI InChI=1S/C25H20N2O3/c1-26(2)25(28)30-24-20-13-8-14-27(20)21-15-18-11-6-7-12-19(18)16-22(21)29-23(24)17-9-4-3-5-10-17/h3-16H,1-2H3
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15n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50315766
PNG
((S)-9-methoxy-2,2,4-trimethyl-5-phenyl-2,5-dihydro...)
Show SMILES COc1ccc2O[C@@H](c3ccccc3)c3c(ccc4NC(C)(C)C=C(C)c34)-c2c1 |r,t:24|
Show InChI InChI=1S/C26H25NO2/c1-16-15-26(2,3)27-21-12-11-19-20-14-18(28-4)10-13-22(20)29-25(24(19)23(16)21)17-8-6-5-7-9-17/h5-15,25,27H,1-4H3/t25-/m0/s1
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18n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052758
PNG
(1-(5-Phenyl-6-oxa-10b-aza-benzo[e]azulen-4-yl)-eth...)
Show SMILES CC(=O)C1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:3|
Show InChI InChI=1S/C20H15NO2/c1-14(22)19-17-11-7-13-21(17)16-10-5-6-12-18(16)23-20(19)15-8-3-2-4-9-15/h2-13H,1H3
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25n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052742
PNG
(Acetic acid 5-naphthalen-2-yl-6-oxa-10b-aza-benzo[...)
Show SMILES CC(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccc2ccccc2c1 |t:4|
Show InChI InChI=1S/C24H17NO3/c1-16(26)27-24-21-10-6-14-25(21)20-9-4-5-11-22(20)28-23(24)19-13-12-17-7-2-3-8-18(17)15-19/h2-15H,1H3
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30n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM13775
PNG
((1S,2R,10S,11S,14R,15S,17S)-14,17-dihydroxy-14-(2-...)
Show SMILES [H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C |t:23|
Show InChI InChI=1S/C21H30O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-16,18,22,24,26H,3-8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1
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30n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Translocator protein


(Rattus norvegicus (rat))
BDBM50052759
PNG
(CHEMBL325471 | Cyclohexanecarboxylic acid 5-phenyl...)
Show SMILES O=C(OC1=C(Oc2ccccc2-n2cccc12)c1ccccc1)C1CCCCC1 |t:3|
Show InChI InChI=1S/C25H23NO3/c27-25(19-12-5-2-6-13-19)29-24-21-15-9-17-26(21)20-14-7-8-16-22(20)28-23(24)18-10-3-1-4-11-18/h1,3-4,7-11,14-17,19H,2,5-6,12-13H2
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32n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50038254
PNG
(Acetic acid 8-methyl-5-phenyl-6-thia-10b-aza-benzo...)
Show SMILES CC(=O)OC1=C(Sc2cc(C)ccc2-n2cccc12)c1ccccc1 |t:4|
Show InChI InChI=1S/C21H17NO2S/c1-14-10-11-17-19(13-14)25-21(16-7-4-3-5-8-16)20(24-15(2)23)18-9-6-12-22(17)18/h3-13H,1-2H3
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44n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50315764
PNG
((S)-5-allyl-9-cyanato-10-methoxy-2,2,4-trimethyl-2...)
Show SMILES COc1c(OC#N)ccc2O[C@@H](CC=C)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |r,t:24|
Show InChI InChI=1S/C24H24N2O3/c1-6-7-17-21-15(8-9-16-20(21)14(2)12-24(3,4)26-16)22-18(29-17)10-11-19(28-13-25)23(22)27-5/h6,8-12,17,26H,1,7H2,2-5H3/t17-/m0/s1
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51n/an/an/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of [3H]DEX from human glucocorticoid receptor


J Med Chem 53: 3065-74 (2010)


Article DOI: 10.1021/jm901452y
BindingDB Entry DOI: 10.7270/Q2VQ33NH
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052743
PNG
(5-Phenyl-6-oxa-10b-aza-benzo[e]azulene-4-carboxyli...)
Show SMILES COC(=O)C1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:4|
Show InChI InChI=1S/C20H15NO3/c1-23-20(22)18-16-11-7-13-21(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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58n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50052756
PNG
(Acetic acid 5-phenyl-6-oxa-12b-aza-naphtho[2,3-e]a...)
Show SMILES CC(=O)OC1=C(Oc2cc3ccccc3cc2-n2cccc12)c1ccccc1 |t:4|
Show InChI InChI=1S/C24H17NO3/c1-16(26)27-24-20-12-7-13-25(20)21-14-18-10-5-6-11-19(18)15-22(21)28-23(24)17-8-3-2-4-9-17/h2-15H,1H3
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108n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
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