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BDBM98559 US8492408, 7b

SMILES: CC(C)(O)c1ccc2n(cnc2c1)-c1ccnc(c1)-c1cccnc1Cl

InChI Key: InChIKey=YDTLVCLHQUJXFS-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 98559   
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
GABA A receptor alpha-1/beta-1/gamma-2


(Homo sapiens (Human))
BDBM98559
PNG
(US8492408, 7b)
Show SMILES CC(C)(O)c1ccc2n(cnc2c1)-c1ccnc(c1)-c1cccnc1Cl
Show InChI InChI=1S/C20H17ClN4O/c1-20(2,26)13-5-6-18-17(10-13)24-12-25(18)14-7-9-22-16(11-14)15-4-3-8-23-19(15)21/h3-12,26H,1-2H3
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 38n/an/an/an/an/an/a



Aniona APS

US Patent


Assay Description
In vitro inhibition assay using GABA receptor.


US Patent US8492408 (2013)


BindingDB Entry DOI: 10.7270/Q28K77QX
More data for this
Ligand-Target Pair