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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Melatonin receptor type 1B
Species	Gallus gallus (Chicken)
Gene
Synonym	Mel-1B-R Mel1b receptor
Disease	N/A for non-human GPCRs
Length	289
Amino acid sequence	GNAFVVSLALADLVVALYPYPLVLLAIFHNGWTLGEMHCKVSGFVMGLSVIGSIFNITAIAINRYCYICHSFAYDKVYSCWNTMLYVSLIWVLTVIATVPNFFVGSLKYDPRIYSCTFVQTASSYYTIAVVVIHFIVPITVVSFCYLRIWVLVLQVRRRVKSETKPRLKPSDFRNFLTMFVVFVIFAFCWAPLNFIGLAVAINPSEMAPKVPEWLFIISYFMAYFNSCLNAIIYGLLNQNFRNEYKRILMSLWMPRLFFQDTSKGGTDGQKSKPSPALNNNDQMKTDTL
UniProt	P51050
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4466
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	N-0889
Molecular formula	C20H22N2O
IUPAC name	N-[2-(2-benzyl-1H-indol-3-yl)ethyl]propanamide
Molecular weight	306.409
Hydrogen bond acceptor	1
Hydrogen bond donor	2
XlogP	4.1
Synonyms	CHEMBL286219 SCHEMBL9401112 BDBM85062 PDSP1_001819 Luzindole,N-propanoyl 2-BENZYL-N-PROPIONYLTRYPTAMINE N-[2-(2-Benzyl-1H-indol-3-yl)ethyl]propionamide PDSP2_001802 N 0889 OLEHNCMFIDHEJG-UHFFFAOYSA-N [ Show all ]
Inchi Key	OLEHNCMFIDHEJG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H22N2O/c1-2-20(23)21-13-12-17-16-10-6-7-11-18(16)22-19(17)14-15-8-4-3-5-9-15/h3-11,22H,2,12-14H2,1H3,(H,21,23)
PubChem CID	19023747
ChEMBL	CHEMBL286219
IUPHAR	N/A
BindingDB	85062
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	1949.84 nM	PMID9840420	BindingDB

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