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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Gamma-aminobutyric acid type B receptor subunit 1
Species	Rattus norvegicus (Rat)
Gene	Gabbr1
Synonym	Gb1 gamma-aminobutyric acid (GABA) B receptor 1 gamma-aminobutyric acid (GABA) B receptor GABABR1 GABAB1 GABA-BR1 GABA-B-R1 GABA-B receptor 1 GPRC3A [ Show all ]
Disease	N/A for non-human GPCRs
Length	991
Amino acid sequence	MLLLLLVPLFLRPLGAGGAQTPNATSEGCQIIHPPWEGGIRYRGLTRDQVKAINFLPVDYEIEYVCRGEREVVGPKVRKCLANGSWTDMDTPSRCVRICSKSYLTLENGKVFLTGGDLPALDGARVEFRCDPDFHLVGSSRSVCSQGQWSTPKPHCQVNRTPHSERRAVYIGALFPMSGGWPGGQACQPAVEMALEDVNSRRDILPDYELKLIHHDSKCDPGQATKYLYELLYNDPIKIILMPGCSSVSTLVAEAARMWNLIVLSYGSSSPALSNRQRFPTFFRTHPSATLHNPTRVKLFEKWGWKKIATIQQTTEVFTSTLDDLEERVKEAGIEITFRQSFFSDPAVPVKNLKRQDARIIVGLFYETEARKVFCEVYKERLFGKKYVWFLIGWYADNWFKTYDPSINCTVEEMTEAVEGHITTEIVMLNPANTRSISNMTSQEFVEKLTKRLKRHPEETGGFQEAPLAYDAIWALALALNKTSGGGGRSGVRLEDFNYNNQTITDQIYRAMNSSSFEGVSGHVVFDASGSRMAWTLIEQLQGGSYKKIGYYDSTKDDLSWSKTDKWIGGSPPADQTLVIKTFRFLSQKLFISVSVLSSLGIVLAVVCLSFNIYNSHVRYIQNSQPNLNNLTAVGCSLALAAVFPLGLDGYHIGRSQFPFVCQARLWLLGLGFSLGYGSMFTKIWWVHTVFTKKEEKKEWRKTLEPWKLYATVGLLVGMDVLTLAIWQIVDPLHRTIETFAKEEPKEDIDVSILPQLEHCSSKKMNTWLGELWSFAVSSDVQRRATVGGDSPICVWPAPESIFYGYKGLLLLLGIFLAYETKSVSTEKINDHRAVGMAIYNVAVLCLITAPVTMILSSQQDAAFAFASLAIVFSSYITLVVLFVPKMRRLITRGEWQSETQDTMKTGSSTNNNEEEKSRLLEKENRELEKIIAEKEERVSELRHQLQSRQQLRSRRHPPTPPDPSGGLPRGPSEPPDRLSCDGSRVHLLYK
UniProt	Q9Z0U4
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL2753
IUPHAR	240
DrugBank	N/A

Ligand

Name	saclofen
Molecular formula	C9H12ClNO3S
IUPAC name	3-amino-2-(4-chlorophenyl)propane-1-sulfonic acid
Molecular weight	249.709
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	-1.7
Synonyms	BPBio1_000705 FT-0692056 MolPort-003-824-767 ST2404869 3-Amino-2-(4-chlorophenyl)-1-propanesulfonic acid API0006972 CHEBI:91596 J-005229 (RS)-3-aMino-2-(4-chlorophenyl)propylsulfonic acid;Saclofen AC-27755 BDBM50286225 Biomol-NT_000242 D0S5YH LS-187609 SC-51070 3-Amino-2-(4-chloro-phenyl)-propane-1-sulfonic acid AKOS015998998 BRD-A24122750-001-01-1 GTPL1078 NCGC00024514-02 X9627 (+/-)-3-amino-2-( 4-chlorophenyl)propanesulfonic acid 3-AMINO-2-(4-CHLOROPHENYL)-PROPANE SULFONIC ACID AX8150722 CHEMBL312403 L001268 Saclofen HCl AC1L3U31 Benzeneethanesulfonic acid, beta-(aminomethyl)-4-chloro- BN0452 DS-18252 MFCD00216817 SCHEMBL339757 3-AMINO-2-(4-CHLOROPHENYL)- PROPANE SULFONIC ACID ANW-45829 BRD-A24122750-001-02-9 HMS3266E05 RT-015626 (RS)-3-amino-2-(4-chlorophenyl)propylsulfonic acid 3-amino-2-(4-chlorophenyl)propane-1-sulfonic acid BCP16740 CTK8B4660 LS-186963 Saclofen, solid 125464-42-8 AK-86940 beta-(Aminomethyl)-4-chlorobenzeneethanesulfonic acid [ Show all ]
Inchi Key	JYLNVJYYQQXNEK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C9H12ClNO3S/c10-9-3-1-7(2-4-9)8(5-11)6-15(12,13)14/h1-4,8H,5-6,11H2,(H,12,13,14)
PubChem CID	122150
ChEMBL	N/A
IUPHAR	1078
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	316228.0 - 398107.0 nM	PMID9069281	IUPHAR

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