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PubMed code 9016329

Compile data set for download or QSAR
Found 5 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
GABA receptor alpha-1/beta-2/gamma-2 subunit


(Homo sapiens (Human))
BDBM50369240
PNG
(GANAXOLONE)
Show SMILES CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@](C)(O)CC[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C22H36O2/c1-14(23)17-7-8-18-16-6-5-15-13-20(2,24)11-12-21(15,3)19(16)9-10-22(17,18)4/h15-19,24H,5-13H2,1-4H3/t15-,16-,17+,18-,19-,20+,21-,22+/m0/s1
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PubMed
n/an/an/an/a 260n/an/an/an/a



CoCensys, Inc.

Curated by ChEMBL


Assay Description
Potentiation of GABA-activated currents in Xenopus oocytes expressing cloned human alpha-1-beta-2-gamma-2L subunits of GABA-A receptor


J Med Chem 40: 61-72 (1997)


Article DOI: 10.1021/jm960021x
BindingDB Entry DOI: 10.7270/Q2M0463J
More data for this
Ligand-Target Pair
GABA receptor alpha-1/beta-2/gamma-2 subunit


(Homo sapiens (Human))
BDBM50454499
PNG
(CHEMBL3137990)
Show SMILES CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@](O)(CC[C@]4(C)[C@H]3CC[C@]12C)C(F)(F)F
Show InChI InChI=1S/C22H33F3O2/c1-13(26)16-6-7-17-15-5-4-14-12-21(27,22(23,24)25)11-10-19(14,2)18(15)8-9-20(16,17)3/h14-18,27H,4-12H2,1-3H3/t14-,15-,16+,17-,18-,19-,20+,21+/m0/s1
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Article
PubMed
n/an/an/an/a 390n/an/an/an/a



CoCensys, Inc.

Curated by ChEMBL


Assay Description
Potentiation of GABA-activated currents in Xenopus oocytes expressing cloned human alpha-1-beta-2-gamma-2L subunits of GABA-A receptor


J Med Chem 40: 61-72 (1997)


Article DOI: 10.1021/jm960021x
BindingDB Entry DOI: 10.7270/Q2M0463J
More data for this
Ligand-Target Pair
GABA receptor alpha-1/beta-2/gamma-2 subunit


(Homo sapiens (Human))
BDBM50055919
PNG
(1-((3R,5S,10S,13S,17S)-3-Azidomethyl-3-hydroxy-10,...)
Show SMILES CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@](O)(CN=[N+]=[N-])CC[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C22H35N3O2/c1-14(26)17-6-7-18-16-5-4-15-12-22(27,13-24-25-23)11-10-20(15,2)19(16)8-9-21(17,18)3/h15-19,27H,4-13H2,1-3H3/t15-,16-,17+,18-,19-,20-,21+,22+/m0/s1
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PC cid
PC sid
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Article
PubMed
n/an/an/an/a 150n/an/an/an/a



CoCensys, Inc.

Curated by ChEMBL


Assay Description
Potentiation of GABA-activated currents in Xenopus oocytes expressing cloned human alpha-1-beta-2-gamma-2L subunits of GABA-A receptor


J Med Chem 40: 61-72 (1997)


Article DOI: 10.1021/jm960021x
BindingDB Entry DOI: 10.7270/Q2M0463J
More data for this
Ligand-Target Pair
GABA receptor alpha-1/beta-2/gamma-2 subunit


(Homo sapiens (Human))
BDBM50454517
PNG
(CHEMBL3137984)
Show SMILES CN(C)C[C@@]1(O)CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@H](C(C)=O)[C@@]4(C)CC[C@H]23)C1
Show InChI InChI=1S/C24H41NO2/c1-16(26)19-8-9-20-18-7-6-17-14-24(27,15-25(4)5)13-12-22(17,2)21(18)10-11-23(19,20)3/h17-21,27H,6-15H2,1-5H3/t17-,18-,19+,20-,21-,22-,23+,24+/m0/s1
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n/an/an/an/a>5.00E+4n/an/an/an/a



CoCensys, Inc.

Curated by ChEMBL


Assay Description
Potentiation of GABA-activated currents in Xenopus oocytes expressing cloned human alpha-1-beta-2-gamma-2L subunits of GABA-A receptor


J Med Chem 40: 61-72 (1997)


Article DOI: 10.1021/jm960021x
BindingDB Entry DOI: 10.7270/Q2M0463J
More data for this
Ligand-Target Pair
GABA receptor alpha-1/beta-2/gamma-2 subunit


(Homo sapiens (Human))
BDBM50191342
PNG
(3alpha-hydroxy-5alpha-pregnan-20-one | CHEMBL20753...)
Show SMILES CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
Show InChI InChI=1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19,23H,4-12H2,1-3H3/t14-,15+,16-,17+,18-,19-,20-,21+/m0/s1
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KEGG
PC cid
PC sid
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Article
PubMed
n/an/an/an/a 160n/an/an/an/a



CoCensys, Inc.

Curated by ChEMBL


Assay Description
Potentiation of GABA-activated currents in Xenopus oocytes expressing cloned human alpha-1-beta-2-gamma-2L subunits of GABA-A receptor


J Med Chem 40: 61-72 (1997)


Article DOI: 10.1021/jm960021x
BindingDB Entry DOI: 10.7270/Q2M0463J
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%