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Compile Data Set for Download or QSAR

Found 27 hits Enz. Inhib. hit(s) with all data for entry = 50034031   
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
Translocator protein


(Rattus norvegicus (rat))
BDBM50355785
PNG
(CHEMBL1911624)
Show SMILES CCCCN(C)C(=O)Cn1c2nn(-c3ccc(F)cc3)c(=O)c2c(C)c2ccccc12
Show InChI InChI=1S/C24H25FN4O2/c1-4-5-14-27(3)21(30)15-28-20-9-7-6-8-19(20)16(2)22-23(28)26-29(24(22)31)18-12-10-17(25)11-13-18/h6-13H,4-5,14-15H2,1-3H3
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n/an/a 0.130n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355784
PNG
(CHEMBL1911623)
Show SMILES CN(C(=O)Cn1c2nn(-c3ccccc3)c(=O)c2c(C)c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C26H21ClN4O2/c1-17-21-10-6-7-11-22(21)30(16-23(32)29(2)19-14-12-18(27)13-15-19)25-24(17)26(33)31(28-25)20-8-4-3-5-9-20/h3-15H,16H2,1-2H3
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n/an/a 0.130n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355781
PNG
(CHEMBL1911620)
Show SMILES CCCCN(C)C(=O)Cn1c2nn(-c3ccccc3)c(=O)c2c(C)c2ccccc12
Show InChI InChI=1S/C24H26N4O2/c1-4-5-15-26(3)21(29)16-27-20-14-10-9-13-19(20)17(2)22-23(27)25-28(24(22)30)18-11-7-6-8-12-18/h6-14H,4-5,15-16H2,1-3H3
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n/an/a 0.140n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355786
PNG
(CHEMBL1911625)
Show SMILES CN(C(=O)Cn1c2nn(-c3ccc(F)cc3)c(=O)c2c(C)c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C26H20ClFN4O2/c1-16-21-5-3-4-6-22(21)31(15-23(33)30(2)19-11-7-17(27)8-12-19)25-24(16)26(34)32(29-25)20-13-9-18(28)10-14-20/h3-14H,15H2,1-2H3
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n/an/a 0.280n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355783
PNG
(CHEMBL1911622)
Show SMILES CCCCN(CCCC)C(=O)Cn1c2nn(-c3ccccc3)c(=O)c2c(C)c2ccccc12
Show InChI InChI=1S/C27H32N4O2/c1-4-6-17-29(18-7-5-2)24(32)19-30-23-16-12-11-15-22(23)20(3)25-26(30)28-31(27(25)33)21-13-9-8-10-14-21/h8-16H,4-7,17-19H2,1-3H3
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n/an/a 0.340n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355782
PNG
(CHEMBL1911621)
Show SMILES CCN(CC)C(=O)Cn1c2nn(-c3ccccc3)c(=O)c2c(C)c2ccccc12
Show InChI InChI=1S/C23H24N4O2/c1-4-25(5-2)20(28)15-26-19-14-10-9-13-18(19)16(3)21-22(26)24-27(23(21)29)17-11-7-6-8-12-17/h6-14H,4-5,15H2,1-3H3
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n/an/a 0.830n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
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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n/an/a 1.30n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Translocator protein


(Rattus norvegicus (rat))
BDBM50355767
PNG
(CHEMBL1911606)
Show SMILES CN(C(=O)Cn1n(-c2ccccc2)c(=O)c2c(C)c3ccccc3nc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C26H21ClN4O2/c1-17-21-10-6-7-11-22(21)28-25-24(17)26(33)31(20-8-4-3-5-9-20)30(25)16-23(32)29(2)19-14-12-18(27)13-15-19/h3-15H,16H2,1-2H3
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n/an/a 1.80n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355777
PNG
(CHEMBL1911616)
Show SMILES CN(C(=O)Cn1n(-c2ccc(F)cc2)c(=O)c2c(C)c3ccccc3nc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C26H20ClFN4O2/c1-16-21-5-3-4-6-22(21)29-25-24(16)26(34)32(20-13-9-18(28)10-14-20)31(25)15-23(33)30(2)19-11-7-17(27)8-12-19/h3-14H,15H2,1-2H3
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n/an/a 6.80n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355780
PNG
(CHEMBL1911619)
Show SMILES CN(C(=O)Cn1n(-c2ccc(Cl)cc2)c(=O)c2c(C)c3ccccc3nc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C26H20Cl2N4O2/c1-16-21-5-3-4-6-22(21)29-25-24(16)26(34)32(20-13-9-18(28)10-14-20)31(25)15-23(33)30(2)19-11-7-17(27)8-12-19/h3-14H,15H2,1-2H3
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n/an/a 16n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355768
PNG
(CHEMBL1911607)
Show SMILES COc1ccc(cc1)N(C)C(=O)Cn1n(-c2ccccc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C27H24N4O3/c1-18-22-11-7-8-12-23(22)28-26-25(18)27(33)31(20-9-5-4-6-10-20)30(26)17-24(32)29(2)19-13-15-21(34-3)16-14-19/h4-16H,17H2,1-3H3
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n/an/a 17n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355761
PNG
(CHEMBL1911600)
Show SMILES CCCCN(C)C(=O)Cn1n(-c2ccccc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C24H26N4O2/c1-4-5-15-26(3)21(29)16-27-23-22(17(2)19-13-9-10-14-20(19)25-23)24(30)28(27)18-11-7-6-8-12-18/h6-14H,4-5,15-16H2,1-3H3
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n/an/a 65n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355776
PNG
(CHEMBL1911615)
Show SMILES CCCN(CCC)C(=O)Cn1n(-c2ccc(F)cc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C25H27FN4O2/c1-4-14-28(15-5-2)22(31)16-29-24-23(17(3)20-8-6-7-9-21(20)27-24)25(32)30(29)19-12-10-18(26)11-13-19/h6-13H,4-5,14-16H2,1-3H3
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n/an/a 87n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355764
PNG
(CHEMBL1911603)
Show SMILES CCCN(CCC)C(=O)Cn1n(-c2ccccc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C25H28N4O2/c1-4-15-27(16-5-2)22(30)17-28-24-23(18(3)20-13-9-10-14-21(20)26-24)25(31)29(28)19-11-7-6-8-12-19/h6-14H,4-5,15-17H2,1-3H3
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n/an/a 90n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355779
PNG
(CHEMBL1911618)
Show SMILES CCCN(CCC)C(=O)Cn1n(-c2ccc(Cl)cc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C25H27ClN4O2/c1-4-14-28(15-5-2)22(31)16-29-24-23(17(3)20-8-6-7-9-21(20)27-24)25(32)30(29)19-12-10-18(26)11-13-19/h6-13H,4-5,14-16H2,1-3H3
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n/an/a 90n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355774
PNG
(CHEMBL1911613)
Show SMILES CCCCN(C)C(=O)Cn1n(-c2ccc(F)cc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C24H25FN4O2/c1-4-5-14-27(3)21(30)15-28-23-22(16(2)19-8-6-7-9-20(19)26-23)24(31)29(28)18-12-10-17(25)11-13-18/h6-13H,4-5,14-15H2,1-3H3
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n/an/a 110n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355766
PNG
(CHEMBL1911605)
Show SMILES CN(C(=O)Cn1n(-c2ccccc2)c(=O)c2c(C)c3ccccc3nc12)c1ccccc1
Show InChI InChI=1S/C26H22N4O2/c1-18-21-15-9-10-16-22(21)27-25-24(18)26(32)30(20-13-7-4-8-14-20)29(25)17-23(31)28(2)19-11-5-3-6-12-19/h3-16H,17H2,1-2H3
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n/an/a 117n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355778
PNG
(CHEMBL1911617)
Show SMILES CCCCN(C)C(=O)Cn1n(-c2ccc(Cl)cc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C24H25ClN4O2/c1-4-5-14-27(3)21(30)15-28-23-22(16(2)19-8-6-7-9-20(19)26-23)24(31)29(28)18-12-10-17(25)11-13-18/h6-13H,4-5,14-15H2,1-3H3
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n/an/a 144n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355765
PNG
(CHEMBL1911604)
Show SMILES CCCCN(CCCC)C(=O)Cn1n(-c2ccccc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C27H32N4O2/c1-4-6-17-29(18-7-5-2)24(32)19-30-26-25(20(3)22-15-11-12-16-23(22)28-26)27(33)31(30)21-13-9-8-10-14-21/h8-16H,4-7,17-19H2,1-3H3
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n/an/a 152n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355762
PNG
(CHEMBL1911601)
Show SMILES CCN(CC)C(=O)Cn1n(-c2ccccc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C23H24N4O2/c1-4-25(5-2)20(28)15-26-22-21(16(3)18-13-9-10-14-19(18)24-22)23(29)27(26)17-11-7-6-8-12-17/h6-14H,4-5,15H2,1-3H3
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n/an/a 180n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355770
PNG
(CHEMBL1911609)
Show SMILES CCN(Cc1ccccc1)C(=O)Cn1n(-c2ccccc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C28H26N4O2/c1-3-30(18-21-12-6-4-7-13-21)25(33)19-31-27-26(20(2)23-16-10-11-17-24(23)29-27)28(34)32(31)22-14-8-5-9-15-22/h4-17H,3,18-19H2,1-2H3
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n/an/a 220n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355771
PNG
(CHEMBL1911610)
Show SMILES CC(C)N(Cc1ccccc1)C(=O)Cn1n(-c2ccccc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C29H28N4O2/c1-20(2)31(18-22-12-6-4-7-13-22)26(34)19-32-28-27(21(3)24-16-10-11-17-25(24)30-28)29(35)33(32)23-14-8-5-9-15-23/h4-17,20H,18-19H2,1-3H3
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n/an/a 304n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355772
PNG
(CHEMBL1911611)
Show SMILES CCCCN(Cc1ccccc1)C(=O)Cn1n(-c2ccccc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C30H30N4O2/c1-3-4-19-32(20-23-13-7-5-8-14-23)27(35)21-33-29-28(22(2)25-17-11-12-18-26(25)31-29)30(36)34(33)24-15-9-6-10-16-24/h5-18H,3-4,19-21H2,1-2H3
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n/an/a 697n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355769
PNG
(CHEMBL1911608)
Show SMILES CN(Cc1ccccc1)C(=O)Cn1n(-c2ccccc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C27H24N4O2/c1-19-22-15-9-10-16-23(22)28-26-25(19)27(33)31(21-13-7-4-8-14-21)30(26)18-24(32)29(2)17-20-11-5-3-6-12-20/h3-16H,17-18H2,1-2H3
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n/an/a 881n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355763
PNG
(CHEMBL1911602)
Show SMILES CC(C)N(C(C)C)C(=O)Cn1n(-c2ccccc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C25H28N4O2/c1-16(2)28(17(3)4)22(30)15-27-24-23(18(5)20-13-9-10-14-21(20)26-24)25(31)29(27)19-11-7-6-8-12-19/h6-14,16-17H,15H2,1-5H3
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n/an/a 1.39E+3n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355775
PNG
(CHEMBL1911614)
Show SMILES CCN(CC)C(=O)Cn1n(-c2ccc(F)cc2)c(=O)c2c(C)c3ccccc3nc12
Show InChI InChI=1S/C23H23FN4O2/c1-4-26(5-2)20(29)14-27-22-21(15(3)18-8-6-7-9-19(18)25-22)23(30)28(27)17-12-10-16(24)11-13-17/h6-13H,4-5,14H2,1-3H3
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n/an/a 2.27E+3n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50355773
PNG
(CHEMBL1911612)
Show SMILES Cc1c2c(nc3ccccc13)n(CC(=O)N(Cc1ccccc1)Cc1ccccc1)n(-c1ccccc1)c2=O
Show InChI InChI=1S/C33H28N4O2/c1-24-28-19-11-12-20-29(28)34-32-31(24)33(39)37(27-17-9-4-10-18-27)36(32)23-30(38)35(21-25-13-5-2-6-14-25)22-26-15-7-3-8-16-26/h2-20H,21-23H2,1H3
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n/an/a 3.46E+3n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat brain homogenates after 90 mins by liquid scintillation spectrometry


J Med Chem 54: 7165-75 (2011)


Article DOI: 10.1021/jm200770f
BindingDB Entry DOI: 10.7270/Q2MG7PWM
More data for this
Ligand-Target Pair