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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.
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Ligand

Name	timolol
Molecular formula	C13H24N4O3S
IUPAC name	(2S)-1-(tert-butylamino)-3-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]propan-2-ol
Molecular weight	316.42
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	1.8
Synonyms	L-714,465 (2S)-1-[(1,1-dimethylethyl)amino]-3-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]propan-2-ol NCGC00016038-02 1-(tert-butylamino)-3-[4-(1,4-oxazinan-4-yl)-1,2,5-thiadiazol-3-yloxy]-(2S)-propan-2-ol NCGC00016798-09 26921-17-5 (maleate (1:1) salt) Oprea1_640981 AC1Q59QM Prestwick3_000948 ARONIS24479 Tenopt Blocadren Timolol anhydrous CAS-26839-75-8 Timololum [INN-Latin] D08600 Timoptol FT-0630529 LS-122231 (S)-1-(tert-Butylamino)-3-((4-morpholino-1,2,5-thiadiazol-3-yl)oxy)propan-2-ol NCGC00016798-03 2-Propanol, 1-((1,1-dimethylethyl)amino)-3-((4-(4-morpholinyl)-1,2,5-thiadiazol-3-yl)oxy)-, (2S)- NCGC00022033-04 5JKY92S7BR Phoxal-timolol (TN) Apo-Timol S-(-)-3-(3-tert-Butylamino-2-hydroxypropoxy)-4-morpholino-1,2,5-thiadiazole Betim Tim-AK (TN) BRD-K08806317-050-03-6 Timolol Maleate, (1:1) Salt CHEBI:9599 Timoptic (TN) DSSTox_CID_3674 Tox21_110614_1 HMS2089I11 (2S)-1-((1,1-dimethylethyl)amino)-3-((4-(4-morpholinyl)-1,2,5-thiadiazol-3-yl)oxy)-2-propanol NC00592 (S)-timolol NCGC00016798-07 2-Propanol,1-[(1,1-dimethylethyl)amino]-3-[[4-(4-morpholinyl)-1,2,5-thiadiazol-3-yl]oxy]-,(2S)- Nu-Timolol AB00513729-17 Prestwick1_000948 Apo-Timop (TN) ST072193 BIDD:GT0073 Timolol (INN) C-19486 Timololo CTK4F8602 Timoptic-XE DTXSID4023674 ZINC2176 Istalol Lopac-T-6394 (2S)-3-[(tert-butyl)amino]-1-(4-morpholin-4-yl(1,2,5-thiadiazol-3-yl)oxy)propa n-2-ol NCGC00016798-01 131628-37-0 NCGC00016798-11 Optimol AKOS015969764 Proflax BBC/645 TIM Blocadren (TN) Timolol GFS CAS-26921-17-5 Timopic Tocris-0649 Gen-Timolol (TN) MK-950 (S)-1-(tert-butylamino)-3-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]propan-2-ol NCGC00016798-05 2-Propanol, 1-((1,1-dimethylethyl)amino)-3-((4-(4-morpholinyl)-1,2,5-thiadiazol-3-yl)oxy)-, (S)- NCGC00022033-05 839T758 PMS-Timolol (TN) Apo-Timol (TN) SCHEMBL4912 Betimol Timacar BRD-K08806317-103-02-5 Timolol [USAN:INN] Timoptic OcuDose DSSTox_GSID_23674 UNII-5JKY92S7BR HMS3259C20 Istalol (TN) (2S)-1-(tert-butylamino)-3-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]propan-2-ol NCGC00016038-01 (S)-timolol (anhydrous) NCGC00016798-08 26839-75-8 Nu-Timolol (TN) AC1L1PYN Prestwick2_000948 Aquanil Temserin BLJRIMJGRPQVNF-JTQLQIEISA-N Timolol (TN) C07141 Timololum D05UVD Timoptic-XE (TN) EINECS 248-032-6 Lopac0_001189 (S)-1-(1,1-(Dimethylethyl)amino)-3-((4-(4-morpholinyl)-1,2,5-thiadiazol-3-yl)oxy)-2-propanol NCGC00016798-02 194288-09-0 NCGC00022033-02 Phoxal-timolol API0004422 S(-)-Timolol maleate BDBM50292219 Tim-AK BPBio1_001008 Timolol maleate CC-35068 Timoptic DB00373 Tox21_110614 GTPL565 (-)-3-Morpholino-4-(3-tert-butylamino-2-hydroxypropoxy)-1,2,5-thiadiazole MolPort-006-125-123 (S)-1-tert-Butylamino-3-(4-morpholin-4-yl-[1,2,5]thiadiazol-3-yloxy)-propan-2-ol NCGC00016798-06 2-Propanol, 1-[(1,1-dimethylethyl)amino]-3-[[4-(4-morpholinyl)-1,2,5-thiadiazol-3-yl]oxy]-, (2S)- Novo-Timol AB00513729 Prestwick0_000948 Apo-Timop SPBio_003075 Betimol (TN) BSPBio_000916 Timolol [USAN] CHEMBL499 Timoptic OcuDose. (TN) DSSTox_RID_77140 W-107148 HSDB 6533 [ Show all ]
Inchi Key	BLJRIMJGRPQVNF-JTQLQIEISA-N
Inchi ID	InChI=1S/C13H24N4O3S/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17/h10,14,18H,4-9H2,1-3H3/t10-/m0/s1
PubChem CID	33624
ChEMBL	CHEMBL499
IUPHAR	565
BindingDB	50292219
DrugBank	DB00373
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
26698	5-hydroxytryptamine receptor 1A	P19327	Htr1a	Rattus norvegicus (Rat)	422
26701	Beta-1 adrenergic receptor	P18090	Adrb1	Rattus norvegicus (Rat)	466
26703	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
26699	Beta-2 adrenergic receptor	Q8K4Z4	Adrb2	Cavia porcellus (Guinea pig)	418
26702	Beta-2 adrenergic receptor	P07550	ADRB2	Homo sapiens (Human)	413
26700	Beta-3 adrenergic receptor	P13945	ADRB3	Homo sapiens (Human)	408
26704	Muscarinic acetylcholine receptor M1	P08482	Chrm1	Rattus norvegicus (Rat)	460

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