BDBM688758 (13R)-13-(difluoromethyl)-9-(2,6-difluorophenyl)-3-methyl-16-thia-2,4,5,8-tetrazatetracyclo [8.6.0.02,6.011,15]hexadeca-1(10),3,5,8,11(15)-pentaene::US20240190889, Example 3

SMILES Cc1nnc2CN=C(c3c4C[C@H](Cc4sc3-n12)C(F)F)c1c(F)cccc1F

InChI Key InChIKey=COKVKKSOZBQKSG-UHFFFAOYSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 688758   

LigandPNGBDBM688758(US20240190889, Example 3 | (13R)-13-(difluoromethy...)
Affinity DataKi:  1.80nMAssay Description:The affinity of compounds at GABAA γ1 subunit-containing receptors was measured by competition for [3H]RO7239181 (67.3 Ci/mmol: Roche) binding t...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2024
Entry Details
US Patent

LigandPNGBDBM688758(US20240190889, Example 3 | (13R)-13-(difluoromethy...)
Affinity DataKi:  2.90nMAssay Description:The affinity of compounds at GABAA γ1 subunit-containing receptors was measured by competition for [3H]RO7239181 (67.3 Ci/mmol: Roche) binding t...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2024
Entry Details
US Patent

LigandPNGBDBM688758(US20240190889, Example 3 | (13R)-13-(difluoromethy...)
Affinity DataKi:  16.8nMAssay Description:The affinity of compounds at GABAA γ1 subunit-containing receptors was measured by competition for [3H]RO7239181 (67.3 Ci/mmol: Roche) binding t...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2024
Entry Details
US Patent

LigandPNGBDBM688758(US20240190889, Example 3 | (13R)-13-(difluoromethy...)
Affinity DataKi:  257nMAssay Description:The affinity of compounds at GABAA γ2 subunit-containing receptors was measured by competition for [3H]Flumazenil (81.1 Ci/mmol; Roche) binding ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2024
Entry Details
US Patent