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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	Domitroban
Molecular formula	C20H27NO4S
IUPAC name	(Z)-7-[(1R,2S,3S,4S)-3-(benzenesulfonamido)-2-bicyclo[2.2.1]heptanyl]hept-5-enoic acid
Molecular weight	377.499
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	3.6
Synonyms	(1r,2s,3s,4s)-(5z)-7-(3-((phenylsulfonyl)amino)bicyclo[2.2.1]hept-2-yl)hept-5-enoic acid 5,7-(3-Phenylsulfonylamino(2.2.1)bicyclohept-2-yl)heptenoic acid Anboxan Domitroban [INN] SCHEMBL361563 112966-96-8 5-Heptenoic acid, 7-(3-((phenylsulfonyl)amino)bicyclo(2.2.1)hept-2-yl)-, (1R-(1alpha,2alpha(Z),3beta,4alpha))- CHEMBL3301671 GTPL1984 UNII-742F5K270Q (+)-S-145 AC1NSM30 S-145 (Thromboxane antagonist) (Z)-7-[(1R,2S,3S,4S)-3-(benzenesulfonamido)-2-bicyclo[2.2.1]heptanyl]hept-5-enoic acid 5-Heptenoic acid, 7-((1R,2S,3S,4S)-3-((phenylsulfonyl)amino)bicyclo(2.2.1)hept-2-yl)-, (5Z)- Calcium 5,7-(3-phenylsulfonylaminobicyclo(2.2.1)hept-2-yl)-5-heptenoate hydrate Domitroban, (+/-)- SCHEMBL361564 115266-92-7 7-(3-((Phenylsulfonyl)amino)bicyclo(2.2.1)hept-2-yl)-5-heptenoic acid, (+/-)-(5Z)- D01HRR LS-172207 [3H]S-145 (+/-)-S-145 Amboxan Domitroban (+/-)-form [MI] S-1452 (Z)-7-[(1R,4S,5S,6S)-5-(phenylsulfonylamino)-6-bicyclo[2.2.1]heptanyl]hept-5-enoic acid 5-Heptenoic acid, 7-((1R,2S,3S,4S)-3-((phenylsulfonyl)amino)bicyclo(2.2.1)hept-2-yl)-, (5Z)-rel- CHEBI:135586 GTPL1979 UNII-6C4W5D1SE7 component PWTCIBWRMQFJBC-ZEMKZVSASA-N (+)-(Z)-7-((1R,2S,3S,4S)-3-Benzenesulfonamido-2-norbornyl)-5-heptenoic acid 132747-47-8 742F5K270Q D0R6BE S-145 [ Show all ]
Inchi Key	PWTCIBWRMQFJBC-ZEMKZVSASA-N
Inchi ID	InChI=1S/C20H27NO4S/c22-19(23)11-7-2-1-6-10-18-15-12-13-16(14-15)20(18)21-26(24,25)17-8-4-3-5-9-17/h1,3-6,8-9,15-16,18,20-21H,2,7,10-14H2,(H,22,23)/b6-1-/t15-,16+,18+,20+/m1/s1
PubChem CID	5312138
ChEMBL	N/A
IUPHAR	1979, 1984
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
554618	Thromboxane A2 receptor	P21731	TBXA2R	Homo sapiens (Human)	343
554619	Thromboxane A2 receptor	P30987	Tbxa2r	Mus musculus (Mouse)	341

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