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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	CHEMBL304599
Molecular formula	C19H22N6O4S
IUPAC name	11-[2-(4-methylpiperazin-1-yl)acetyl]-6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepine-8-sulfonamide
Molecular weight	430.483
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	-1.3
Synonyms	11-[(4-Methyl-1-piperazinyl)acetyl]-6-oxo-6,11-dihydro-5H-pyrido[2,3-b][1,4]benzodiazepine-8-sulfonamide # BXLNCQMGWFYCMI-UHFFFAOYSA-N 11-[2-(4-methylpiperazin-1-yl)acetyl]-6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepine-8-sulfonamide CTK6I3131 AC1LBK9X 11-[(4-methylpiperazin-1-yl)acetyl]-6-oxo-6,11-dihydro-5h-pyrido[2,3-b][1,4]benzodiazepine-8-sulfonamide 5,11-Dihydro-11-[(4-methyl-1-piperazinyl)acetyl]-6-oxo-6H-pyrido[2,3-b][1,4]benzodiazepine-8-sulfonamide Pirenzepine, 8-sulfamoyl- BDBM50012335 11-[2-(4-Methyl-piperazin-1-yl)-acetyl]-6-oxo-6,11-dihydro-5H-benzo[e]pyrido[3,2-b][1,4]diazepine-8-sulfonic acid amide [ Show all ]
Inchi Key	BXLNCQMGWFYCMI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H22N6O4S/c1-23-7-9-24(10-8-23)12-17(26)25-16-5-4-13(30(20,28)29)11-14(16)19(27)22-15-3-2-6-21-18(15)25/h2-6,11H,7-10,12H2,1H3,(H,22,27)(H2,20,28,29)
PubChem CID	537285
ChEMBL	CHEMBL304599
IUPHAR	N/A
BindingDB	50012335
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
35191	Muscarinic acetylcholine receptor M1	P08482	Chrm1	Rattus norvegicus (Rat)	460
35192	Muscarinic acetylcholine receptor M2	P10980	Chrm2	Rattus norvegicus (Rat)	466
35193	Muscarinic acetylcholine receptor M3	P08483	Chrm3	Rattus norvegicus (Rat)	589

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