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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	SK&F-104078
Molecular formula	C16H22ClNO
IUPAC name	6-chloro-3-methyl-9-(3-methylbut-2-enoxy)-1,2,4,5-tetrahydro-3-benzazepine
Molecular weight	279.808
Hydrogen bond acceptor	2
Hydrogen bond donor	0
XlogP	4.4
Synonyms	6-chloro-3-methyl-9-(3-methylbut-2-enoxy)-1,2,4,5-tetrahydro-3-benzazepine CTK4A7072 LS-172138 SKF-104078 1H-3-Benzazepine, 6-chloro-2,3,4,5-tetrahydro-3-methyl-9-((3-methyl-2-butenyl)oxy)- BDBM50030623 SCHEMBL8091302 SK-104078 AC1L3UBS D08OWQ PDSP1_000610 skf104078 1H-3-Benzazepine,6-chloro-2,3,4,5-tetrahydro-3-methyl-9-[(3-methyl-2-buten-1-yl)oxy]- BRD-K62103095-001-01-6 SK&F 104078 6-Chloro-3-methyl-9-(3-methyl-but-2-enyloxy)-2,3,4,5-tetrahydro-1H-benzo[d]azepine CHEMBL114166 Skf 104078 110857-22-2 ACMC-20mdr0 DTXSID40149402 PDSP2_000607 UNII-22XBK6DY1E 22XBK6DY1E CHEBI:125603 [ Show all ]
Inchi Key	MBYSTKNEMJZSIK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H22ClNO/c1-12(2)8-11-19-16-5-4-15(17)13-6-9-18(3)10-7-14(13)16/h4-5,8H,6-7,9-11H2,1-3H3
PubChem CID	122295
ChEMBL	CHEMBL114166
IUPHAR	N/A
BindingDB	50030623
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
201801	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
201788	Alpha-1B adrenergic receptor	P35368	ADRA1B	Homo sapiens (Human)	520
201794	Alpha-1D adrenergic receptor	P25100	ADRA1D	Homo sapiens (Human)	572
201789	Alpha-2A adrenergic receptor	P22909	Adra2a	Rattus norvegicus (Rat)	450
201790	Alpha-2A adrenergic receptor	P08913	ADRA2A	Homo sapiens (Human)	450
201791	Alpha-2A adrenergic receptor	Q28838	ADRA2A	Bos taurus (Bovine)	452
201799	Alpha-2A adrenergic receptor	P18871	ADRA2A	Sus scrofa (Pig)	450
201793	Alpha-2B adrenergic receptor	O77715	ADRA2B	Didelphis virginiana (North American opossum)	382
201797	Alpha-2B adrenergic receptor	P19328	Adra2b	Rattus norvegicus (Rat)	453
201798	Alpha-2B adrenergic receptor	O77830	ADRA2B	Oryctolagus cuniculus (Rabbit)	394
201800	Alpha-2B adrenergic receptor	P18089	ADRA2B	Homo sapiens (Human)	450
201792	Alpha-2C adrenergic receptor	P18825	ADRA2C	Homo sapiens (Human)	462
201796	Alpha-2C adrenergic receptor	P22086	Adra2c	Rattus norvegicus (Rat)	458

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