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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	2-Iodomelatonin
Molecular formula	C13H15IN2O2
IUPAC name	N-[2-(2-iodo-5-methoxy-1H-indol-3-yl)ethyl]acetamide
Molecular weight	358.179
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	2.3
Synonyms	ZINC2516056 2-I-MLT Acetamide, N-(2-(2-iodo-5-methoxy-1H-indol-3-yl)ethyl)- CCG-204699 DTXSID30239462 L000060 N-acetyl-2-iodo-5-methoxytriptamine NCGC00024758-02 AKOS024458623 CHEMBL289233 FT-0737435 LS-9790 N-[2-(2-IODO-5-METHOXYINDOL-3-YL)ETHYL]ACETAMIDE SCHEMBL163451 AC1L3GZ8 BN0011 D0H6YF I 1899 MolPort-003-983-480 NCGC00015552-03 SR-01000075935-3 2-iodo-melatonin Acetamide, N-(2-(2-iodo-5-methoxy-1H-indol-3-yl)ethyl)-, (3beta)- CHEBI:109558 EU-0100610 Lopac-I-1899 N-Acetyl-2-iodo-5-methoxytryptamine PDSP1_001785 93515-00-5 B6428 CTK8F4316 GTPL1343 Melatonin,2-Iodo NCGC00015552-01 SR-01000075935 Tocris-0737 AC1Q5P6Z BRD-K25649279-001-01-2 DB08190 KB-270628 N-(2-(2-Iodo-5-methoxy-1H-indol-3-yl)ethyl)acetamide NCGC00024758-01 acetamide,n-[2-(2-iodo-5-methoxy-1h-indol-3-yl)ethyl]- FJDDSMSDZHURBJ-UHFFFAOYSA-N Lopac0_000610 n-[2-(2-iodo-5-methoxy-1h-indol-3-yl)ethyl]acetamide PDSP2_001768 A15343 BDBM29611 D08VEJ HMS3266P03 ML2 NCGC00015552-02 SR-01000075935-1 [ Show all ]
Inchi Key	FJDDSMSDZHURBJ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C13H15IN2O2/c1-8(17)15-6-5-10-11-7-9(18-2)3-4-12(11)16-13(10)14/h3-4,7,16H,5-6H2,1-2H3,(H,15,17)
PubChem CID	115348
ChEMBL	CHEMBL289233
IUPHAR	1343
BindingDB	29611
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
79643	Melatonin receptor type 1A	P48039	MTNR1A	Homo sapiens (Human)	350
79646	Melatonin receptor type 1A	O02781	MTNR1A	Sus scrofa (Pig)	154
79647	Melatonin receptor type 1A	P48040	MTNR1A	Ovis aries (Sheep)	366
79645	Melatonin receptor type 1B	P49286	MTNR1B	Homo sapiens (Human)	362
79644	Thyrotropin receptor	P16473	TSHR	Homo sapiens (Human)	764

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