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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	ml375
Molecular formula	C23H15ClF2N2O2
IUPAC name	(9bS)-9b-(4-chlorophenyl)-1-(3,4-difluorobenzoyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one
Molecular weight	424.832
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	4.3
Synonyms	CHEMBL3105228 (9bS)-9b-(4-chlorophenyl)-1-(3,4-difluorobenzoyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one ML-375 BDBM50445222 D02KZD GTPL7631 VU0483253-3 [ Show all ]
Inchi Key	GXBAKXRLQAPKEE-QHCPKHFHSA-N
Inchi ID	InChI=1S/C23H15ClF2N2O2/c24-16-8-6-15(7-9-16)23-18-4-2-1-3-17(18)22(30)28(23)12-11-27(23)21(29)14-5-10-19(25)20(26)13-14/h1-10,13H,11-12H2/t23-/m0/s1
PubChem CID	71598521
ChEMBL	CHEMBL3105228
IUPHAR	7631
BindingDB	50445222
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
107438	Cannabinoid receptor 1	P21554	CNR1	Homo sapiens (Human)	472
107439	Muscarinic acetylcholine receptor M1	P11229	CHRM1	Homo sapiens (Human)	460
107440	Muscarinic acetylcholine receptor M1	P08482	Chrm1	Rattus norvegicus (Rat)	460
107433	Muscarinic acetylcholine receptor M2	P10980	Chrm2	Rattus norvegicus (Rat)	466
107436	Muscarinic acetylcholine receptor M2	P08172	CHRM2	Homo sapiens (Human)	466
107431	Muscarinic acetylcholine receptor M3	P08483	Chrm3	Rattus norvegicus (Rat)	589
107437	Muscarinic acetylcholine receptor M3	P20309	CHRM3	Homo sapiens (Human)	590
107434	Muscarinic acetylcholine receptor M4	P08485	Chrm4	Rattus norvegicus (Rat)	478
107435	Muscarinic acetylcholine receptor M4	P08173	CHRM4	Homo sapiens (Human)	479
107430	Muscarinic acetylcholine receptor M5	P08912	CHRM5	Homo sapiens (Human)	532
107432	Muscarinic acetylcholine receptor M5	P08911	Chrm5	Rattus norvegicus (Rat)	531

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