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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	CHEMBL99361
Molecular formula	C10H13NO3
IUPAC name	1-(aminomethyl)-3,4-dihydro-1H-isochromene-5,6-diol
Molecular weight	195.218
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	0.0
Synonyms	1-Aminomethyl-3,4-dihydro-1H-2-benzopyran-5,6-diol 1H-2-Benzopyran-5,6-diol, 1-(aminomethyl)-3,4-dihydro- BDBM50010891 1-Aminomethyl-isochroman-5,6-diol D0U6IL 1-(aminomethyl)-3,4-dihydro-5,6-dihydroxy-1h-2-benzopyran 1-Aminomethyl-isochroman-5,6-diol; hydrobromide SCHEMBL8726506 83694-56-8 [ Show all ]
Inchi Key	JBSRTZUQAXYSQB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C10H13NO3/c11-5-9-6-1-2-8(12)10(13)7(6)3-4-14-9/h1-2,9,12-13H,3-5,11H2
PubChem CID	13864381
ChEMBL	CHEMBL99361
IUPHAR	N/A
BindingDB	50010891
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
147022	Beta-1 adrenergic receptor	P18090	Adrb1	Rattus norvegicus (Rat)	466
147023	Beta-2 adrenergic receptor	Q28044	ADRB2	Bos taurus (Bovine)	418
147024	Beta-2 adrenergic receptor	Q8K4Z4	Adrb2	Cavia porcellus (Guinea pig)	418
147019	D(1A) dopamine receptor	P18901	Drd1	Rattus norvegicus (Rat)	446
147020	D(1A) dopamine receptor	P21728	DRD1	Homo sapiens (Human)	446
147021	D(2) dopamine receptor	P61169	Drd2	Rattus norvegicus (Rat)	444

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