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Compile Data Set for Download or QSAR

Found 3 hits of ic50 for UniProtKB: P63138   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Gamma-aminobutyric acid receptor subunit alpha-6/beta-2/delta


(Rattus norvegicus (Rat)-RAT)
BDBM50457439
PNG
(CHEMBL4213357)
Show SMILES Clc1ccc(cc1)C(=O)Nc1c(nc2c(Br)cc(Br)cn12)-c1cccs1
Show InChI InChI=1S/C18H10Br2ClN3OS/c19-11-8-13(20)16-22-15(14-2-1-7-26-14)17(24(16)9-11)23-18(25)10-3-5-12(21)6-4-10/h1-9H,(H,23,25)
PDB

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
n/an/a 150n/an/an/an/an/an/a



Johannes Gutenberg University Mainz

Curated by ChEMBL


Assay Description
Displacement of [3H]EBOB from rat GABA-A receptor alpha6beta2delta expressed in HEK293 cell membranes after 90 mins by liquid scintillation counting ...


J Med Chem 61: 1951-1968 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01484
BindingDB Entry DOI: 10.7270/Q2P271Q0
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-6/beta-2/delta


(Rattus norvegicus (Rat)-RAT)
BDBM50457444
PNG
(CHEMBL4213793)
Show SMILES FCCCCOc1ccc(cc1)C(=O)Nc1c(nc2c(Br)cc(Br)cn12)-c1cccs1
Show InChI InChI=1S/C22H18Br2FN3O2S/c23-15-12-17(24)20-26-19(18-4-3-11-31-18)21(28(20)13-15)27-22(29)14-5-7-16(8-6-14)30-10-2-1-9-25/h3-8,11-13H,1-2,9-10H2,(H,27,29)
PDB

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 270n/an/an/an/an/an/a



Johannes Gutenberg University Mainz

Curated by ChEMBL


Assay Description
Displacement of [3H]EBOB from rat GABA-A receptor alpha6beta2delta expressed in HEK293 cell membranes after 90 mins by liquid scintillation counting ...


J Med Chem 61: 1951-1968 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01484
BindingDB Entry DOI: 10.7270/Q2P271Q0
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-6/beta-2/delta


(Rattus norvegicus (Rat)-RAT)
BDBM50457438
PNG
(CHEMBL4208971)
Show SMILES CCCCOc1ccc(cc1)C(=O)Nc1c(nc2ccc(Br)cn12)-c1cccs1
Show InChI InChI=1S/C22H20BrN3O2S/c1-2-3-12-28-17-9-6-15(7-10-17)22(27)25-21-20(18-5-4-13-29-18)24-19-11-8-16(23)14-26(19)21/h4-11,13-14H,2-3,12H2,1H3,(H,25,27)
PDB

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.43E+3n/an/an/an/an/an/a



Johannes Gutenberg University Mainz

Curated by ChEMBL


Assay Description
Displacement of [3H]EBOB from rat GABA-A receptor alpha6beta2delta expressed in HEK293 cell membranes after 90 mins by liquid scintillation counting ...


J Med Chem 61: 1951-1968 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01484
BindingDB Entry DOI: 10.7270/Q2P271Q0
More data for this
Ligand-Target Pair