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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	SMR000220470
Molecular formula	C18H20N4
IUPAC name	N-[2-(cyclohexen-1-yl)ethyl]-5H-pyrimido[5,4-b]indol-4-amine
Molecular weight	292.386
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	4.1
Synonyms	(2-Cyclohex-1-enyl-ethyl)-(5H-pyrimido[5,4-b]indol-4-yl)-amine cid_944164 N-[2-(cyclohexen-1-yl)ethyl]-5H-pyrimido[5,4-b]indol-4-amine 847047-09-0 MCULE-5777162591 ZINC8682478 BDBM42058 N-[2-(1-cyclohexenyl)ethyl]-5H-pyrimido[5,4-b]indol-4-amine 2-(cyclohexen-1-yl)ethyl-(5H-pyrimid[5,4-b]indol-4-yl)amine HMS2549M14 AC1LJ4OP MLS000580267 CHEMBL1428566 N-[2-(cyclohex-1-en-1-yl)ethyl]-5H-pyrimido[5,4-b]indol-4-amine KUC103466N STL344920 AKOS022096201 MolPort-002-617-740 [ Show all ]
Inchi Key	BGFVIPOCYPUSEB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H20N4/c1-2-6-13(7-3-1)10-11-19-18-17-16(20-12-21-18)14-8-4-5-9-15(14)22-17/h4-6,8-9,12,22H,1-3,7,10-11H2,(H,19,20,21)
PubChem CID	944164
ChEMBL	N/A
IUPHAR	N/A
BindingDB	42058
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
22952	Galanin receptor type 2	O43603	GALR2	Homo sapiens (Human)	387
22951	Galanin receptor type 3	O60755	GALR3	Homo sapiens (Human)	368

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