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BDBM133423 US8846719, 108

SMILES: Cc1onc(c1COc1ccc(cn1)C(=O)NC1CC1)-c1ccc(F)cc1

InChI Key: InChIKey=NWMXUWGTUPIHCX-UHFFFAOYSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 133423   
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-5 (GABA(A))


(Homo sapiens (Human))
BDBM133423
PNG
(US8846719, 108)
Show SMILES Cc1onc(c1COc1ccc(cn1)C(=O)NC1CC1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H18FN3O3/c1-12-17(19(24-27-12)13-2-5-15(21)6-3-13)11-26-18-9-4-14(10-22-18)20(25)23-16-7-8-16/h2-6,9-10,16H,7-8,11H2,1H3,(H,23,25)
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Similars

US Patent
1.10 -11.4n/an/an/an/an/a7.54



Roche Palo Alto LLC

US Patent


Assay Description
Radioligand binding assays were carried out in a volume of 200 mL (96-well plates) which contained 100 mL of cell memebranes, [3H]flumazenil at a con...


US Patent US8846719 (2014)


BindingDB Entry DOI: 10.7270/Q2V986RV
More data for this
Ligand-Target Pair