Zhang Lab

University of Michigan

Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only

Online Services

●I-TASSER ●I-TASSER-MTD ●C-I-TASSER ●CR-I-TASSER ●QUARK ●C-QUARK ●LOMETS ●MUSTER ●CEthreader ●SEGMER ●DeepFold ●DeepFoldRNA ●FoldDesign ●COFACTOR ●COACH ●MetaGO ●TripletGO ●IonCom ●FG-MD ●ModRefiner ●REMO ●DEMO ●DEMO-EM ●DMFold ●SPRING ●COTH ●Threpp ●PEPPI ●BSpred ●ANGLOR ●EDock ●BSP-SLIM ●SAXSTER ●FUpred ●ThreaDom ●ThreaDomEx ●EvoDesign ●BindProf ●BindProfX ●SSIPe ●GPCR-I-TASSER ●MAGELLAN ●ResQ ●STRUM ●DAMpred

●TM-score ●TM-align ●US-align ●MM-align ●RNA-align ●NW-align ●LS-align ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●TripletRes ●DeepPotential ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●FASPR ●EM-Refiner ●GPU-I-TASSER

●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	(R)-Baclofen
Molecular formula	C10H12ClNO2
IUPAC name	(3R)-4-amino-3-(4-chlorophenyl)butanoic acid
Molecular weight	213.661
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	-1.0
Synonyms	MolPort-002-507-841 s3072 STX209 (R)-4-amino-3-(4-chlorophenyl)butan-oic acid 2C0 AGI-006 Arbaclofen (USAN) C21605 D0W4PJ I04-1358 KS-00000LLT p-chlorophenyl GABA SR-01000597441-1 (-)-Baclofen UNII-H789N3FKE8 component KPYSYYIEGFHWSV-QMMMGPOBSA-N (R)-4-Amino-3-(4-chlorophenyl)butyric Acid 69308-37-8 AKOS015893035 B5102 CS-13178 DTXSID90219366 M03BX01 R-Baclofen STX 209 (R)-(-)-Baclofen ZINC61 0687AC AC-22385 API0000916 Benzenepropanoic acid, beta-(aminomethyl)-4-chloro-, (R)- D03ZYQ GTPL3428 NCGC00024796-01 SCHEMBL351220 TC-161761 (R)-4-Amino-3-(4-chlorophenyl)butanoic acid 308A378 AJ-07845 Arbaclofen [USAN:INN] CHEMBL301742 KB-63255 l-Baclofen PubChem18285 ST079288 (3R)-4-amino-3-(4-chlorophenyl)butanoic acid UNII-NYU6UTW25B A9172 AN-37917 BDBM50032964 CTK8C4757 FT-0662468 MCULE-5448996279 R-Baclofen RS STX-209 (R)-4-Amino-3-(4-chloro-phenyl)-butyric acid [3H](R)-(-)-baclofen AC1L2C6G Arbaclofen BG0394 D09791 HY-17354 NYU6UTW25B SR-01000597441 Tocris-0796 (R)-4-Amino-3-(4-chlorophenyl)butanoicacid 4-Amino-3-(4-chloro-phenyl)-butyric acid AK109161 AX8047687 CS-0889 DB08891 KPYSYYIEGFHWSV-QMMMGPOBSA-N LS-182284 R-(-)-Baclofen ST24035487 (betaR)-beta-(Aminomethyl)-4-chlorobenzenepropanoic acid W-5262 (\|AR)-\|A-(Aminomethyl)-4-chlorobenzenepropanoic Acid AB01566870_01 ANW-73016 Benzeneporopanoic acid, (beta-(aminomethyl)-4-chloro-, (betaR)- d-Baclofen GTPL1064 [ Show all ]
Inchi Key	KPYSYYIEGFHWSV-QMMMGPOBSA-N
Inchi ID	InChI=1S/C10H12ClNO2/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)/t8-/m0/s1
PubChem CID	44602
ChEMBL	N/A
IUPHAR	1064
BindingDB	N/A
DrugBank	DB08891
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
550092	Gamma-aminobutyric acid type B receptor subunit 1	Q9UBS5	GABBR1	Homo sapiens (Human)	961
554164	Gamma-aminobutyric acid type B receptor subunit 1	Q9Z0U4	Gabbr1	Rattus norvegicus (Rat)	991
550091	Gamma-aminobutyric acid type B receptor subunit 2	O75899	GABBR2	Homo sapiens (Human)	941

zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218