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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	CHEMBL302005
Molecular formula	C20H21NO3
IUPAC name	2-[(11E)-11-[2-(dimethylamino)ethylidene]-6H-benzo[c][1]benzoxepin-2-yl]acetic acid
Molecular weight	323.392
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	1.0
Synonyms	BDBM50002088 [11-(2-Dimethylamino-ethylidene)-6,11-dihydro-dibenzo[b,e]oxepin-2-yl]-acetic acid 6,11-Dihydro-11-[(E)-2-dimethylaminoethylidene]dibenz[b,e]oxepin-2-acetic acid 6,11-Dihydro-11-[2-(dimethylamino)ethylidene]dibenz[b,e]oxepin-2-acetic acid
Inchi Key	BMMSDSQQAGDCHS-RQZCQDPDSA-N
Inchi ID	InChI=1S/C20H21NO3/c1-21(2)10-9-17-16-6-4-3-5-15(16)13-24-19-8-7-14(11-18(17)19)12-20(22)23/h3-9,11H,10,12-13H2,1-2H3,(H,22,23)/b17-9+
PubChem CID	15749427
ChEMBL	CHEMBL302005
IUPHAR	N/A
BindingDB	50002088
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
27628	Histamine H1 receptor	P35367	HRH1	Homo sapiens (Human)	487
27629	Histamine H1 receptor	P31389	HRH1	Cavia porcellus (Guinea pig)	488
27631	Muscarinic acetylcholine receptor M1	P08482	Chrm1	Rattus norvegicus (Rat)	460
27630	Thromboxane A2 receptor	P21731	TBXA2R	Homo sapiens (Human)	343

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