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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	Ergoatetrine
Molecular formula	C19H23N3O2
IUPAC name	N-(1-hydroxypropan-2-yl)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
Molecular weight	325.412
Hydrogen bond acceptor	3
Hydrogen bond donor	3
XlogP	1.8
Synonyms	9-(2-Hydroxy-1-methylethylcarbamoyl)-4,6,6a,7,8,9-hexahydro-7-methylindolo[4,3-fg]quinoline Cornocentin (Salt/Mix) Ermetrine (Salt/Mix) PDSP1_001743 Biomol-NT_000067 N-(1-(Hydroxymethyl)ethyl)-D-lysergomide 9,10-Didehydro-N-(.alpha.-(hydroxymethyl)ethyl)-6-methylergoline-8-.beta.-carboxamide CHEBI:91849 Ergoline-8-carboxamide, 9,10-didehydro-N-(2-hydroxy-1-methylethyl)-6-methyl-, [8.beta.(S)]- NSC_104873 AC1L1FIH Crude ergot (Salt/Mix) L000683 PDSP2_001726 BPBio1_001359 Ergoline-8-.alpha.-carboxamide, 9,10-didehydro-N-((S)-2-hydroxy-1-methylethyl)-6-methyl- N-(2-Hydroxy-1-methylethyl)-6-methyl-9,10-didehydroergoline-8.beta.(S)-carboxamide # 9,10-Didehydro-N-[(S)-2-hydroxy-1-methylethyl]-6-methylergoline-8.beta.-carboxamide CHEMBL1368134 Ergotrate (Salt/Mix) Oprea1_121118 BDBM81446 D-Lysergic acid-L,2-propanolamide N-(.alpha.-(Hydroxymethyl)ethyl)-D-lysergomide WVVSZNPYNCNODU-UHFFFAOYSA-N 9,10-Didehydro-N-((S)-2-hydroxy-1-methylethyl)-6-methylergoline-8-.alpha.-carboxamide BRD-A73581086-001-01-3 Ergoline-8-.beta.-carboxamide, 9,10-didehydro-N-((S)-2-hydroxy-1-methylethyl)-6-methyl- NCGC00163165-01 [ Show all ]
Inchi Key	WVVSZNPYNCNODU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H23N3O2/c1-11(10-23)21-19(24)13-6-15-14-4-3-5-16-18(14)12(8-20-16)7-17(15)22(2)9-13/h3-6,8,11,13,17,20,23H,7,9-10H2,1-2H3,(H,21,24)
PubChem CID	3250
ChEMBL	N/A
IUPHAR	N/A
BindingDB	81446
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
383570	5-hydroxytryptamine receptor 1E	P28566	HTR1E	Homo sapiens (Human)	365
383568	5-hydroxytryptamine receptor 2A	P50128	HTR2A	Macaca mulatta (Rhesus macaque)	471
383569	5-hydroxytryptamine receptor 2A	P50129	HTR2A	Sus scrofa (Pig)	470
557086	5-hydroxytryptamine receptor 2A	P14842	Htr2a	Rattus norvegicus (Rat)	471
383567	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458
557087	5-hydroxytryptamine receptor 7	P32305	Htr7	Rattus norvegicus (Rat)	448
557088	Alpha-1A adrenergic receptor	P43140	Adra1a	Rattus norvegicus (Rat)	466

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