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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'GABA receptor alpha-1 subunit' AND taxid = 10090   
Target
(Institution)
LigandTarget
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
GABA receptor alpha-1 subunit


(Mus musculus)
BDBM50001561
PNG
(5-(6-Imino-3-thiophen-3-yl-6H-pyridazin-1-ylmethyl...)
Show SMILES N=c1ccc(nn1Cc1cc(=O)[nH]o1)-c1ccsc1
Show InChI InChI=1S/C12H10N4O2S/c13-11-2-1-10(8-3-4-19-7-8)14-16(11)6-9-5-12(17)15-18-9/h1-5,7,13H,6H2,(H,15,17)
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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

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PubMed
n/an/a 88n/an/an/an/an/an/a



Centre de Neurochimie du CNRS

Curated by ChEMBL


Assay Description
Affinity for gamma-aminobutyric-acid A receptor measured by its ability to displace [3H]gabazine antagonist from rat brain preparations.


J Med Chem 35: 4092-7 (1992)

More data for this
Ligand-Target Pair
GABA receptor alpha-1 subunit


(Mus musculus)
BDBM50001562
PNG
(5-(6-Imino-3-phenyl-6H-pyridazin-1-ylmethyl)-isoxa...)
Show SMILES N=c1ccc(nn1Cc1cc(=O)[nH]o1)-c1ccccc1
Show InChI InChI=1S/C14H12N4O2/c15-13-7-6-12(10-4-2-1-3-5-10)16-18(13)9-11-8-14(19)17-20-11/h1-8,15H,9H2,(H,17,19)
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UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 240n/an/an/an/an/an/a



Centre de Neurochimie du CNRS

Curated by ChEMBL


Assay Description
Affinity for gamma-aminobutyric-acid A receptor measured by its ability to displace [3H]gabazine antagonist from rat brain preparations.


J Med Chem 35: 4092-7 (1992)

More data for this
Ligand-Target Pair
GABA receptor alpha-1 subunit


(Mus musculus)
BDBM50001556
PNG
(4-(6-Imino-5-methyl-3-phenyl-6H-pyridazin-1-yl)-bu...)
Show SMILES Cc1cc(nn(CCCC(O)=O)c1=N)-c1ccccc1
Show InChI InChI=1S/C15H17N3O2/c1-11-10-13(12-6-3-2-4-7-12)17-18(15(11)16)9-5-8-14(19)20/h2-4,6-7,10,16H,5,8-9H2,1H3,(H,19,20)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 800n/an/an/an/an/an/a



Centre de Neurochimie du CNRS

Curated by ChEMBL


Assay Description
Affinity for gamma-aminobutyric-acid A receptor measured by its ability to displace [3H]gabazine antagonist from rat brain preparations.


J Med Chem 35: 4092-7 (1992)

More data for this
Ligand-Target Pair