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BDBM10678 US8846719, 291

SMILES: Cc1onc(C2CCC(F)CN2)c1COc1ccc(cn1)C(=O)NC(C)(C)CO

InChI Key: InChIKey=MIAIMIAKGNNYDJ-UHFFFAOYNA-N

Data: 1 KI

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

Found 1 hit for monomerid = 10678   
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))
BDBM10678
PNG
(US8846719, 291)
Show SMILES Cc1onc(C2CCC(F)CN2)c1COc1ccc(cn1)C(=O)NC(C)(C)CO
Show InChI InChI=1/C20H27FN4O4/c1-12-15(18(25-29-12)16-6-5-14(21)9-22-16)10-28-17-7-4-13(8-23-17)19(27)24-20(2,3)11-26/h4,7-8,14,16,22,26H,5-6,9-11H2,1-3H3,(H,24,27)
PDB

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PC sid
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Similars

US Patent
1.20 -11.3n/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