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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	BDBM81766
Molecular formula	C44H56N8O7
IUPAC name	9-(4-aminobutyl)-3-benzyl-15-[(4-hydroxyphenyl)methyl]-12-(1H-indol-3-ylmethyl)-1,18-dimethyl-6-propan-2-yl-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone
Molecular weight	808.981
Hydrogen bond acceptor	8
Hydrogen bond donor	8
XlogP	3.9
Synonyms	NSC_3086456 CAS_3086456 L001102
Inchi Key	NPJIOCBFOAHEDO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C44H56N8O7/c1-26(2)38-43(58)50-37(23-28-12-6-5-7-13-28)44(59)52(4)27(3)39(54)48-35(22-29-17-19-31(53)20-18-29)41(56)49-36(24-30-25-46-33-15-9-8-14-32(30)33)42(57)47-34(40(55)51-38)16-10-11-21-45/h5-9,12-15,17-20,25-27,34-38,46,53H,10-11,16,21-24,45H2,1-4H3,(H,47,57)(H,48,54)(H,49,56)(H,50,58)(H,51,55)
PubChem CID	13105142
ChEMBL	N/A
IUPHAR	N/A
BindingDB	81766
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons.

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
229009	Somatostatin receptor type 1	P30872	SSTR1	Homo sapiens (Human)	391
229001	Somatostatin receptor type 2	P30874	SSTR2	Homo sapiens (Human)	369
556375	Somatostatin receptor type 2	P30680	Sstr2	Rattus norvegicus (Rat)	369
556376	Somatostatin receptor type 2	P30875	Sstr2	Mus musculus (Mouse)	369
229005	Somatostatin receptor type 3	P32745	SSTR3	Homo sapiens (Human)	418
229006	Somatostatin receptor type 3	P30935	Sstr3	Mus musculus (Mouse)	428
229008	Somatostatin receptor type 3	P30936	Sstr3	Rattus norvegicus (Rat)	428
229002	Somatostatin receptor type 4	P31391	SSTR4	Homo sapiens (Human)	388
229007	Somatostatin receptor type 4	P30937	Sstr4	Rattus norvegicus (Rat)	384
461210	Somatostatin receptor type 4	P49660	Sstr4	Mus musculus (Mouse)	385
229003	Somatostatin receptor type 5	P35346	SSTR5	Homo sapiens (Human)	364
229004	Somatostatin receptor type 5	P30938	Sstr5	Rattus norvegicus (Rat)	363

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