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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	Vapreotide
Molecular formula	C57H70N12O9S2
IUPAC name	10-(4-aminobutyl)-N-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-19-[(2-amino-3-phenylpropanoyl)amino]-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-7-propan-2-yl-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide
Molecular weight	1131.38
Hydrogen bond acceptor	13
Hydrogen bond donor	13
XlogP	3.6
Synonyms	Vapreotide (USAN/INN) D-Phenylalanyl-L-cysteinyl-L-tyrosyl-D-tryptophyl-L-lysyl-L-valyl-L-cysteinyl-L-tryptophanamide cyclic (2-7)-disulfide L-Tryptophanamide, D-phenylalanyl-L-cysteinyl-L-tyrosyl-D-tryptophyl-L-lysyl-L-valyl-L-cysteinyl-, cyclic (2->7)-disulfide AN-7497 D07DSQ NSC_71306 SCHEMBL6369050 103222-11-3 CAS_71306 I06-1827 Vapreotide acetate AC1L2FXK D-Phenylalanyl-L-cysteinyl-L-tyrosyl-D-tryptophyl-L-lysyl-L-valyl-L-cysteinyl-L-tryptophanamide cyclic (2->7)-disulfide L001100 RC 160 10-(4-aminobutyl)-N-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-19-[(2-amino-3-phenylpropanoyl)amino]-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-7-propan-2-yl-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide BDBM82464 Docrised (TN) 13-((1H-indol-3-yl)methyl)-N-(1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl)-19-(2-amino-3-phenylpropanamido)-10-(4-aminobutyl)-16-(4-hydroxybenzyl)-7-isopropyl-6,9,12,15,18-pentaoxo-1 CCRIS 6495 L-Tryptophanamide, D-phenylalanyl-L-cysteinyl-L-tyrosyl-D-tryptophyl-L-lysyl-L-valyl-L-cysteinyl-, cyclic (2-7)-disulfide Vapreotide [USAN:INN] (4R,7S,10S,13R,16S,19R)-13-((1H-Indol-3-yl)methyl)-N-((S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl)-19-((R)-2-amino-3-phenylpropanamido)-10-(4-aminobutyl)-16-(4-hydroxybenzyl)-7-isopropyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan AKOS015896024 D06281 LS-171852 Sanvar IR 10-(4-aminobutyl)-N-[2-amino-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-19-[(2-amino-3-phenyl-propanoyl)amino]-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-3-ylmethyl)-7-isopropyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide C57H70N12O9S2 FT-0652516 [ Show all ]
Inchi Key	SWXOGPJRIDTIRL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C57H70N12O9S2/c1-32(2)49-57(78)68-48(55(76)64-44(50(60)71)26-35-28-61-41-16-8-6-14-38(35)41)31-80-79-30-47(67-51(72)40(59)24-33-12-4-3-5-13-33)56(77)65-45(25-34-19-21-37(70)22-20-34)53(74)66-46(27-36-29-62-42-17-9-7-15-39(36)42)54(75)63-43(52(73)69-49)18-10-11-23-58/h3-9,12-17,19-22,28-29,32,40,43-49,61-62,70H,10-11,18,23-27,30-31,58-59H2,1-2H3,(H2,60,71)(H,63,75)(H,64,76)(H,65,77)(H,66,74)(H,67,72)(H,68,78)(H,69,73)
PubChem CID	71306
ChEMBL	N/A
IUPHAR	N/A
BindingDB	82464
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. 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
325273	Somatostatin receptor type 1	P30872	SSTR1	Homo sapiens (Human)	391
325271	Somatostatin receptor type 2	P30874	SSTR2	Homo sapiens (Human)	369
556793	Somatostatin receptor type 2	P30875	Sstr2	Mus musculus (Mouse)	369
556794	Somatostatin receptor type 2	P30680	Sstr2	Rattus norvegicus (Rat)	369
325272	Somatostatin receptor type 3	P32745	SSTR3	Homo sapiens (Human)	418
325274	Somatostatin receptor type 3	P30935	Sstr3	Mus musculus (Mouse)	428
325276	Somatostatin receptor type 3	P30936	Sstr3	Rattus norvegicus (Rat)	428
325269	Somatostatin receptor type 4	P31391	SSTR4	Homo sapiens (Human)	388
462034	Somatostatin receptor type 4	P49660	Sstr4	Mus musculus (Mouse)	385
325270	Somatostatin receptor type 5	P35346	SSTR5	Homo sapiens (Human)	364
325275	Somatostatin receptor type 5	P30938	Sstr5	Rattus norvegicus (Rat)	363

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