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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	CHEMBL173497
Molecular formula	C28H24FN5O2
IUPAC name	4-ethynyl-3-[[3-fluoro-4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]phenyl]-hydroxymethyl]-N,N-dimethylindole-1-carboxamide
Molecular weight	481.531
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	3.5
Synonyms	4-Ethynyl-3-{[3-fluoro-4-(2-methyl-imidazo[4,5-c]pyridin-1-ylmethyl)-phenyl]-hydroxy-methyl}-indole-1-carboxylic acid dimethylamide BDBM50062108 200418-10-6 N,N-Dimethyl-4-ethynyl-3-[[4-[(2-methyl-1H-imidazo[4,5-c]pyridine-1-yl)methyl]-3-fluorophenyl]hydroxymethyl]-1H-indole-1-carboxamide 4-ethynyl-3-[[3-fluoro-4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]phenyl]-hydroxymethyl]-N,N-dimethylindole-1-carboxamide AC1L4BQ3 1H-Indole-1-carboxamide, 4-ethynyl-3-((3-fluoro-4-((2-methyl-1H-imidazo(4,5-c)pyridin-1-yl)methyl)phenyl)hydroxymethyl)-N,N-dimethyl- [ Show all ]
Inchi Key	BVMRYQJBOWKAAH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H24FN5O2/c1-5-18-7-6-8-25-26(18)21(16-34(25)28(36)32(3)4)27(35)19-9-10-20(22(29)13-19)15-33-17(2)31-23-14-30-12-11-24(23)33/h1,6-14,16,27,35H,15H2,2-4H3
PubChem CID	154122
ChEMBL	CHEMBL173497
IUPHAR	N/A
BindingDB	50062108
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
33880	Platelet-activating factor receptor	P21556	PTAFR	Cavia porcellus (Guinea pig)	342
33881	Platelet-activating factor receptor	P46002	Ptafr	Rattus norvegicus (Rat)	341

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