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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	paxilline
Molecular formula	C27H33NO4
IUPAC name	(1S,2R,5S,7R,11S,14S)-11-hydroxy-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6-oxa-23-azahexacyclo[12.10.0.02,11.05,10.016,24.017,22]tetracosa-9,16(24),17,19,21-pentaen-8-one
Molecular weight	435.564
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	3.5
Synonyms	EDD20523-48C0-4594-B22A-1FE297F60611 IDI1_033897 KC-155 NCGC00025342-07_C27H33NO4_(2R,4bS,6aS,12bS,12cR,14aS)-4b-Hydroxy-2-(2-hydroxy-2-propanyl)-12b,12c-dimethyl-5,6,6a,7,12,12b,12c,13,14,14a-decahydro-2H-chromeno[5',6':6,7]indeno[1,2-b]indol-3(4bH)-one SR-01000597527 2H-Pyrano(2'',3'':5',6')benz(1',2':6,7)indeno(1,2-b)indol-3(4bH)-one, 5,6,6a,7,12,12b,12c,13,14,14a-decahydro-4b-hydroxy-2-(1-hydroxy-1-methylethyl)-12b,12c-dimethyl-, (2R,4bS,6aS,12bS,12cR,14aS)- Bio1_001106 C-22304 HMS1791H09 KBio2_005283 MFCD00083464 Paxilline solution, 100 mug/mL in acetonitrile, analytical standard ZINC3996035 AC1L2XVK BN0414 CC-33483 HMS3268F05 KBioGR_000147 NCGC00025342-05 SMR000058863 (2R,4bS,6aS,12bS,12cR,14aS)-5,6,6a,7,12,12b,12c,13,14,14a-Decahydro-4b-hydroxy-2-(1-hydroxy-1-methylethyl)-12b,12c-dimethyl-2H-pyrano[2'',3'':5',6']benz[1',2':6,7]indeno[1,2-b]indol-3(4bH)-one Bio1_000128 BRN 5317894 CHEMBL410063 FT-0630697 KBio2_000147 LS-39378 NSC 658707 SR-01000597527-1 3T9U9Z96L7 Bio2_000147 C13782 HMS1989H09 KBio3_000293 MLS000028812 Paxilline, powder, >=98% (HPLC) ZX-AFC003114 AKOS024456907 BRD-K38251852-001-02-5 CHEBI:34907 cid_105008 HMS3402H09 KBioSS_000147 NCGC00025342-07 Spectrum5_001975 2H-1-Benzopyrano(5',6':6,7)indeno(1,2-b)indol-3(4bh)-one, 5,6,6a,7,12,12b,12c,13,14,14a-decahydro-4b-hydroxy-2-(1-hydroxy-1-methylethyl)-12b,12c-dimethyl-, (2-alpha,4b-beta,6a-alpha,12b-beta,12c-alpha,14a-beta)- Bio1_000617 BSPBio_001427 HMS1361H09 KBio2_002715 MCULE-5541524519 UNII-3T9U9Z96L7 57186-25-1 Bio2_000627 CBiol_001842 HMS2232J18 KBio3_000294 MolPort-003-983-661 SCHEMBL361232 BDBM50854 BRD-K38251852-001-06-6 [ Show all ]
Inchi Key	ACNHBCIZLNNLRS-UBGQALKQSA-N
Inchi ID	InChI=1S/C27H33NO4/c1-24(2,30)23-20(29)14-18-21(32-23)10-11-25(3)26(4)15(9-12-27(18,25)31)13-17-16-7-5-6-8-19(16)28-22(17)26/h5-8,14-15,21,23,28,30-31H,9-13H2,1-4H3/t15-,21-,23-,25+,26+,27+/m0/s1
PubChem CID	105008
ChEMBL	CHEMBL410063
IUPHAR	N/A
BindingDB	N/A
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
1718	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
1719	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371

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