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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	CHEMBL311229
Molecular formula	C23H29N3O3S
IUPAC name	[4-[[(9-methyl-4,5-dihydro-[1]benzoxepino[5,4-d][1,3]thiazol-2-yl)amino]methyl]piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone
Molecular weight	427.563
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	4.0
Synonyms	BDBM50145232 {4-[(9-Methyl-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulen-2-ylamino)-methyl]-piperidin-1-yl}-(R)-tetrahydro-furan-2-yl-methanone
Inchi Key	PQAHPKKBCMEGKW-LJQANCHMSA-N
Inchi ID	InChI=1S/C23H29N3O3S/c1-15-4-5-18-17(13-15)21-20(8-12-29-18)30-23(25-21)24-14-16-6-9-26(10-7-16)22(27)19-3-2-11-28-19/h4-5,13,16,19H,2-3,6-12,14H2,1H3,(H,24,25)/t19-/m1/s1
PubChem CID	9867212
ChEMBL	CHEMBL311229
IUPHAR	N/A
BindingDB	50145232
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
265993	Neuropeptide Y receptor type 1	P25929	NPY1R	Homo sapiens (Human)	384
265990	Neuropeptide Y receptor type 2	P49146	NPY2R	Homo sapiens (Human)	381
265992	Neuropeptide Y receptor type 4	P50391	NPY4R	Homo sapiens (Human)	375
265989	Neuropeptide Y receptor type 5	Q15761	NPY5R	Homo sapiens (Human)	445
265991	Neuropeptide Y receptor type 5	Q63634	Npy5r	Rattus norvegicus (Rat)	445

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