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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	SMR000131790
Molecular formula	C23H16N2O4
IUPAC name	(3E)-1-(4-hydroxyphenyl)-3-[(4-nitrophenyl)methylidene]-5-phenylpyrrol-2-one
Molecular weight	384.391
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	4.6
Synonyms	(3E)-1-(4-hydroxyphenyl)-3-[(4-nitrophenyl)methylidene]-5-phenyl-2-pyrrolone CB06365 SR-01000415359-1 cid_5346268 BDBM55412 MLS000521382 (3E)-1-(4-hydroxyphenyl)-3-[(4-nitrophenyl)methylidene]-5-phenyl-pyrrol-2-one SMSF0011405 ZINC5073018 AC1NT6FQ HMS2458A11 (3E)-1-(4-hydroxyphenyl)-3-(4-nitrobenzylidene)-5-phenyl-2-pyrrolin-2-one BIM-0004097.P001 MolPort-006-780-803 (3E)-1-(4-hydroxyphenyl)-3-[(4-nitrophenyl)methylidene]-5-phenylpyrrol-2-one CHEMBL1491719 SR-01000415359 AKOS003221962 HMS644F04 [ Show all ]
Inchi Key	GQDXXWHROQBAHL-NBVRZTHBSA-N
Inchi ID	InChI=1S/C23H16N2O4/c26-21-12-10-19(11-13-21)24-22(17-4-2-1-3-5-17)15-18(23(24)27)14-16-6-8-20(9-7-16)25(28)29/h1-15,26H/b18-14+
PubChem CID	5346268
ChEMBL	CHEMBL1491719
IUPHAR	N/A
BindingDB	55412
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
102560	C-C chemokine receptor type 6	P51684	CCR6	Homo sapiens (Human)	374
102561	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332
102562	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371
475587	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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