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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	CHEMBL44246
Molecular formula	C27H31N5O3
IUPAC name	5-(diaminomethylideneamino)-2-[(2,2-diphenylacetyl)amino]-N-[(4-hydroxyphenyl)methyl]pentanamide
Molecular weight	473.577
Hydrogen bond acceptor	4
Hydrogen bond donor	5
XlogP	2.5
Synonyms	NSC_5311023 BDBM84996 CAS_5311023 2-Diphenylacetylamino-5-guanidino-pentanoic acid 4-hydroxy-benzylamide L000127 BDBM50065469 [ Show all ]
Inchi Key	KUWBXRGRMQZCSS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H31N5O3/c28-27(29)30-17-7-12-23(25(34)31-18-19-13-15-22(33)16-14-19)32-26(35)24(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-6,8-11,13-16,23-24,33H,7,12,17-18H2,(H,31,34)(H,32,35)(H4,28,29,30)
PubChem CID	21129772
ChEMBL	CHEMBL44246
IUPHAR	N/A
BindingDB	50065469, 84996
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
556188	Neuropeptide FF receptor 2	Q9Y5X5	NPFFR2	Homo sapiens (Human)	522
178868	Neuropeptide Y receptor type 1	P25929	NPY1R	Homo sapiens (Human)	384
178870	Neuropeptide Y receptor type 1	Q9WVD0	NPY1R	Cavia porcellus (Guinea pig)	383
178869	Neuropeptide Y receptor type 2	Q9Z2D5	NPY2R	Cavia porcellus (Guinea pig)	381
178871	Neuropeptide Y receptor type 2	P49146	NPY2R	Homo sapiens (Human)	381
178867	Neuropeptide Y receptor type 5	Q15761	NPY5R	Homo sapiens (Human)	445
556190	Neuropeptide Y receptor type 5	Q63634	Npy5r	Rattus norvegicus (Rat)	445
556189	Prolactin-releasing peptide receptor	P49683	PRLHR	Homo sapiens (Human)	370

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