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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	118101-09-0
Molecular formula	C24H22N4O2
IUPAC name	1-[(3R)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea
Molecular weight	398.466
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	3.8
Synonyms	L365260 S-L-365,260 CTK8E7435 N-[(3R)-2,3-Dihydro-1-methyl-2-oxo-5-phenyl-1H-1,4-benzodiazepin-3-yl]-N'-(3-methylphenyl)urea Urea, N-(2,3-dihydro-1-methyl-2-oxo-5-phenyl-1H-1,4-benzodiazepin-3-yl)-N'-(3-methylphenyl)-, (R)- B7181 KS-0000181W L-365,260 PDSP2_000907 CHEBI:79548 MolPort-001-729-072 SCHEMBL5931098 AC1NSK78 J-003705 NCGC00371056-01 ZINC3797417 (R)-N-(2,3-Dihydro-1-methyl-2-oxo-5-phenyl-1H-1,4-benzodiazepin-3-yl)-N'-(3-methylphenyl)-urea BDBM81962 L 365,260 L-365260 RT-013478 370JHF4586 N-((3R)-2,3-dihydro-1-methyl-2-oxo-5-phenyl-1H-1,4-benzodiazepin-3-yl)-N'-(3-methylphenyl)urea UNII-370JHF4586 AKOS024457284 KDFQABSFVYLGPM-QFIPXVFZSA-N L 365260 PDSP1_000921 1-[(3R)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea C15026 [ Show all ]
Inchi Key	KDFQABSFVYLGPM-QFIPXVFZSA-N
Inchi ID	InChI=1S/C24H22N4O2/c1-16-9-8-12-18(15-16)25-24(30)27-22-23(29)28(2)20-14-7-6-13-19(20)21(26-22)17-10-4-3-5-11-17/h3-15,22H,1-2H3,(H2,25,27,30)/t22-/m0/s1
PubChem CID	5311201
ChEMBL	CHEMBL9387
IUPHAR	N/A
BindingDB	81962
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
166347	Cholecystokinin receptor type A	P30551	Cckar	Rattus norvegicus (Rat)	444
166349	Cholecystokinin receptor type A	O08786	Cckar	Mus musculus (Mouse)	436
166351	Cholecystokinin receptor type A	Q63931	CCKAR	Cavia porcellus (Guinea pig)	430
166352	Cholecystokinin receptor type A	P32238	CCKAR	Homo sapiens (Human)	428
166346	Gastrin/cholecystokinin type B receptor	P32239	CCKBR	Homo sapiens (Human)	447
166348	Gastrin/cholecystokinin type B receptor	P56481	Cckbr	Mus musculus (Mouse)	453
166350	Gastrin/cholecystokinin type B receptor	P30553	Cckbr	Rattus norvegicus (Rat)	452

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