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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	SCHEMBL2235117
Molecular formula	C22H27ClN2O2
IUPAC name	1-[[3-[[(1R)-1-(4-chloro-3-methylphenyl)propyl]amino]phenyl]methyl]-3-methylazetidine-3-carboxylic acid
Molecular weight	386.92
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	2.5
Synonyms	ANHBAXBXTSPASS-HXUWFJFHSA-N CHEMBL3671022 1-{3-[(R)-1-(4-Chloro-3-methyl-phenyl)-propylamino]-benzyl}-3-methyl-azetidine-3-carboxylic acid BDBM127510 US8791100, 8
Inchi Key	ANHBAXBXTSPASS-HXUWFJFHSA-N
Inchi ID	InChI=1S/C22H27ClN2O2/c1-4-20(17-8-9-19(23)15(2)10-17)24-18-7-5-6-16(11-18)12-25-13-22(3,14-25)21(26)27/h5-11,20,24H,4,12-14H2,1-3H3,(H,26,27)/t20-/m1/s1
PubChem CID	53340432
ChEMBL	CHEMBL3671022
IUPHAR	N/A
BindingDB	127510
DrugBank	N/A
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
9559	Sphingosine 1-phosphate receptor 1	P21453	S1PR1	Homo sapiens (Human)	382

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