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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	MLS000058422
Molecular formula	C15H19ClN2O3
IUPAC name	[2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl] 3-cyclopentylpropanoate
Molecular weight	310.778
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	3.4
Synonyms	3-cyclopentylpropanoic acid [2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] ester CHEMBL1542860 SR-01000055397 762251-06-9 MCULE-9226800238 ZINC2623125 BDBM31011 MolPort-004-047-917 [2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl] 3-cyclopentylpropanoate 3-cyclopentylpropionic acid [2-[(5-chloro-2-pyridyl)amino]-2-keto-ethyl] ester cid_2085057 SR-01000055397-1 AC1M0XC0 [(5-chloropyridin-2-yl)carbamoyl]methyl 3-cyclopentylpropanoate SMR000064084 HMS2404C05 Z18433691 AKOS033620448 MLS002633704 [2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 3-cyclopentylpropanoate [ Show all ]
Inchi Key	CFPAPTHPFYHAJT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C15H19ClN2O3/c16-12-6-7-13(17-9-12)18-14(19)10-21-15(20)8-5-11-3-1-2-4-11/h6-7,9,11H,1-5,8,10H2,(H,17,18,19)
PubChem CID	2085057
ChEMBL	CHEMBL1542860
IUPHAR	N/A
BindingDB	31011
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
40843	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
40845	5-hydroxytryptamine receptor 1E	P28566	HTR1E	Homo sapiens (Human)	365
467923	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593
40844	Sphingosine 1-phosphate receptor 3	Q99500	S1PR3	Homo sapiens (Human)	378

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