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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	NVP-QAV680
Molecular formula	C18H18N2O4S
IUPAC name	2-[2-methyl-1-[(4-methylsulfonylphenyl)methyl]pyrrolo[2,3-b]pyridin-3-yl]acetic acid
Molecular weight	358.412
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	2.0
Synonyms	SCHEMBL1941180 AKOS027422678 HY-12284 1H-Pyrrolo(2,3-b)pyridine-3-acetic acid, 2-methyl-1-((4-(methylsulfonyl)phenyl)methyl)- NVP-QAV680 /NVPQAV680 DB11658 QAV680 UNII-0E3D72URPD BCP28134 NVP-QAV-680 2-(2-methyl-1-(4-(methylsulfonyl)benzyl)-1H-pyrrolo[2,3-b]pyridin-3-yl)acetic acid CHEMBL2442750 QAV-680 872365-16-7 GTPL8996 QAV690 free acid ZINC34600373 0E3D72URPD BDBM50442299 2-[2-methyl-1-[(4-methylsulfonylphenyl)methyl]pyrrolo[5,4-b]pyridin-3-yl]acetic acid CS-3461 QAV-690 free acid [ Show all ]
Inchi Key	YOPFAMROKXHVCQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H18N2O4S/c1-12-16(10-17(21)22)15-4-3-9-19-18(15)20(12)11-13-5-7-14(8-6-13)25(2,23)24/h3-9H,10-11H2,1-2H3,(H,21,22)
PubChem CID	11508736
ChEMBL	CHEMBL2442750
IUPHAR	N/A
BindingDB	50442299
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
415513	Prostacyclin receptor	P43119	PTGIR	Homo sapiens (Human)	386
415511	Prostaglandin D2 receptor	Q13258	PTGDR	Homo sapiens (Human)	359
415505	Prostaglandin D2 receptor 2	Q9Z2J6	Ptgdr2	Mus musculus (Mouse)	382
415506	Prostaglandin D2 receptor 2	Q9Y5Y4	PTGDR2	Homo sapiens (Human)	395
415507	Prostaglandin E2 receptor EP2 subtype	P43116	PTGER2	Homo sapiens (Human)	358
415510	Prostaglandin E2 receptor EP3 subtype	P43115	PTGER3	Homo sapiens (Human)	390
415508	Prostaglandin E2 receptor EP4 subtype	P35408	PTGER4	Homo sapiens (Human)	488
415512	Prostaglandin F2-alpha receptor	P43088	PTGFR	Homo sapiens (Human)	359
415509	Thromboxane A2 receptor	P21731	TBXA2R	Homo sapiens (Human)	343

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