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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	CHEMBL3769933
Molecular formula	C21H24ClN5O3S
IUPAC name	3-[2-[5-(3-chloro-4-propan-2-yloxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]propanoic acid
Molecular weight	461.965
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	1.3
Synonyms	BDBM50149566 compound 43 [PMID: 26751273] SCHEMBL2125026 GTPL9492 2-[5-(3-Chloro-4-isopropoxyphenyl)-1,3,4-thiadiazole-2-yl]-3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[4,3-c]pyridine-5-propanoic acid J3.605.586C 3-[2-[5-(3-chloro-4-propan-2-yloxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]propanoic acid [ Show all ]
Inchi Key	BGAJNPLDJJBRHK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H24ClN5O3S/c1-12(2)30-18-5-4-14(10-16(18)22)20-23-24-21(31-20)27-13(3)15-11-26(9-7-19(28)29)8-6-17(15)25-27/h4-5,10,12H,6-9,11H2,1-3H3,(H,28,29)
PubChem CID	49848557
ChEMBL	CHEMBL3769933
IUPHAR	9492
BindingDB	50149566
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
519802	Sphingosine 1-phosphate receptor 1	P21453	S1PR1	Homo sapiens (Human)	382
519804	Sphingosine 1-phosphate receptor 2	O95136	S1PR2	Homo sapiens (Human)	353
519801	Sphingosine 1-phosphate receptor 3	Q99500	S1PR3	Homo sapiens (Human)	378
519803	Sphingosine 1-phosphate receptor 4	O95977	S1PR4	Homo sapiens (Human)	384
519800	Sphingosine 1-phosphate receptor 5	Q9H228	S1PR5	Homo sapiens (Human)	398

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