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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	CHEMBL191303
Molecular formula	C40H55N11O5
IUPAC name	N-[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]octanamide
Molecular weight	769.952
Hydrogen bond acceptor	7
Hydrogen bond donor	9
XlogP	3.0
Synonyms	BDBM50166125 Octanoic acid [(S)-1-((R)-1-{(S)-1-[(S)-1-carbamoyl-2-(1H-indol-3-yl)-ethylcarbamoyl]-4-guanidino-butylcarbamoyl}-2-phenyl-ethylcarbamoyl)-2-(3H-imidazol-4-yl)-ethyl]-amide
Inchi Key	HEAWAGYKTOLXON-HVRNLMOBSA-N
Inchi ID	InChI=1S/C40H55N11O5/c1-2-3-4-5-9-18-35(52)48-34(22-28-24-44-25-47-28)39(56)51-33(20-26-13-7-6-8-14-26)38(55)49-31(17-12-19-45-40(42)43)37(54)50-32(36(41)53)21-27-23-46-30-16-11-10-15-29(27)30/h6-8,10-11,13-16,23-25,31-34,46H,2-5,9,12,17-22H2,1H3,(H2,41,53)(H,44,47)(H,48,52)(H,49,55)(H,50,54)(H,51,56)(H4,42,43,45)/t31-,32-,33+,34-/m0/s1
PubChem CID	10078903
ChEMBL	CHEMBL191303
IUPHAR	N/A
BindingDB	50166125
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons.

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
112539	Melanocortin receptor 3	P33033	Mc3r	Mus musculus (Mouse)	323
112542	Melanocortin receptor 4	P56450	Mc4r	Mus musculus (Mouse)	332
112540	Melanocortin receptor 5	P41149	Mc5r	Mus musculus (Mouse)	325
112541	Melanocyte-stimulating hormone receptor	Q01727	Mc1r	Mus musculus (Mouse)	315

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