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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	MLS000549502
Molecular formula	C34H45N3O3
IUPAC name	N-[3-(adamantane-1-carbonylamino)-5-(piperidine-1-carbonyl)phenyl]adamantane-1-carboxamide
Molecular weight	543.752
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	5.7
Synonyms	AK-968/12971281 MolPort-001-670-434 SR-01000441741 N-[3-(1-adamantylcarbonylamino)-5-piperidin-1-ylcarbonyl-phenyl]adamantane-1-carboxamide ZINC8432758 HMS2371J23 N-[3-[[1-adamantyl(oxo)methyl]amino]-5-[oxo(1-piperidinyl)methyl]phenyl]-1-adamantanecarboxamide AKOS001628852 N,N'-[5-(piperidin-1-ylcarbonyl)-1,3-phenylene]diadamantane-1-carboxamide SR-01000441741-1 CHEMBL1309450 N-[3-(adamantane-1-carbonylamino)-5-(piperidine-1-carbonyl)phenyl]adamantane-1-carboxamide AC1N802K SMR000114790 BDBM41588 N,N'-[5-(piperidin-1-ylcarbonyl)benzene-1,3-diyl]bistricyclo[3.3.1.1~3,7~]decane-1-carboxamide STL172005 cid_4287683 N-[3-[(1-adamantylcarbonyl)amino]-5-(1-piperidinylcarbonyl)phenyl]-1-adamantanecarboxamide [ Show all ]
Inchi Key	CZWKWMBVBQSYHN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C34H45N3O3/c38-30(37-4-2-1-3-5-37)27-12-28(35-31(39)33-15-21-6-22(16-33)8-23(7-21)17-33)14-29(13-27)36-32(40)34-18-24-9-25(19-34)11-26(10-24)20-34/h12-14,21-26H,1-11,15-20H2,(H,35,39)(H,36,40)
PubChem CID	4287683
ChEMBL	CHEMBL1309450
IUPHAR	N/A
BindingDB	41588
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

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
54726	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
54725	Sphingosine 1-phosphate receptor 2	O95136	S1PR2	Homo sapiens (Human)	353

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