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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	MLS000334786
Molecular formula	C24H17N5O2
IUPAC name	N-[(E)-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]pyridine-3-carboxamide
Molecular weight	407.433
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	3.8
Synonyms	N-[(E)-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]pyridine-3-carboxamide SMR000249544 AC1OBYG9 N-[(E)-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-pyridinecarboxamide CHEMBL3198860 N-[(E)-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]pyridine-3-carboxamide BDBM96047 N-[(E)-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]nicotinamide cid_6905845 [ Show all ]
Inchi Key	CAEZKMVXBNAAGV-CVKSISIWSA-N
Inchi ID	InChI=1S/C24H17N5O2/c30-24(18-8-6-12-25-14-18)27-26-15-19-16-29(20-9-2-1-3-10-20)28-23(19)22-13-17-7-4-5-11-21(17)31-22/h1-16H,(H,27,30)/b26-15+
PubChem CID	6905845
ChEMBL	CHEMBL3198860
IUPHAR	N/A
BindingDB	N/A
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
37097	Beta-2 adrenergic receptor	P07550	ADRB2	Homo sapiens (Human)	413
37098	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
37099	Neurotensin receptor type 1	P30989	NTSR1	Homo sapiens (Human)	418
467505	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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