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SMILES: COC[C@]12CC[C@@](C)(O)C[C@@H]1CC[C@H]1[C@@H]3CC[C@H](C(=O)Cn4nnc5c(F)c(F)ccc45)[C@@]3(C)CC[C@H]21

InChI Key: InChIKey=JUKIOILIHXZUES-DTZLGSCESA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 403330   
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 (GABA) B receptor 1


(Rattus norvegicus (rat))		BDBM403330
PNG
(US10329320, Compound 7)
Show SMILES COC[C@]12CC[C@@](C)(O)C[C@@H]1CC[C@H]1[C@@H]3CC[C@H](C(=O)Cn4nnc5c(F)c(F)ccc45)[C@@]3(C)CC[C@H]21 |r|
Show InChI InChI=1S/C29H39F2N3O3/c1-27(36)12-13-29(16-37-3)17(14-27)4-5-18-19-6-7-21(28(19,2)11-10-20(18)29)24(35)15-34-23-9-8-22(30)25(31)26(23)32-33-34/h8-9,17-21,36H,4-7,10-16H2,1-3H3/t17-,18-,19-,20-,21+,27+,28-,29+/m0/s1
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
TBPS binding assays using rat brain cortical membranes in the presence of 5 μM GABA has been described (Gee et al, J. Pharmacol. Exp. Ther. 1987...

PubChem Bioassay (2006)


BindingDB Entry DOI: 10.7270/Q22N54NV
More data for this
Ligand-Target Pair