Aspirin

Aspirin

SCHEMBL408904

CC(=O)Oc1ccccc1C(=O)O.NCC(=O)O.NCCCC[C@H](N)C(=O)O

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGS1PTGS2

The experimentally established mechanism targets of Aspirin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 known ✓ P23219 1/20 0.56
PTGS2 known ✓ P35354 1/20 0.56
KDM4E B2RXH2 8/20 0.56
HSD17B10 Q99714 7/20 0.56
HPGD P15428 5/20 0.56
ALDH1A1 P00352 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
ITGB3 P05106 2/20 0.56
ITGA2B P08514 2/20 0.56
ESR1 P03372 1/20 0.56
HMGB1 P09429 1/20 0.56
TSHR P16473 1/20 0.56
GGT1 P19440 1/20 0.56
BLM P54132 1/20 0.56
NAPRT Q6XQN6 1/20 0.56
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
GSR P00390 1/20 0.47
KMT2A Q03164 3/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Aspirin SCHEMBL29743138 1.00 KDM4E (0.56) KDM4EHSD17B10HPGDALDH1A1TDP1
Aspirin SCHEMBL19030830 1.00 KDM4E (0.56) KDM4EHSD17B10HPGDALDH1A1TDP1
Aspirin SCHEMBL25878 0.96 KDM4E (0.60) KDM4EHSD17B10HPGDALDH1A1TDP1
Aspirin SCHEMBL25877 0.96 KDM4E (0.60) KDM4EHSD17B10HPGDALDH1A1TDP1
Aspirin SCHEMBL4834297 0.96 KDM4E (0.60) KDM4EHSD17B10HPGDALDH1A1TDP1
Aspirin SCHEMBL11851702 0.96 KDM4E (0.60) KDM4EHSD17B10HPGDALDH1A1TDP1
Aspirin SCHEMBL29743139 0.96 KDM4E (0.60) KDM4EHSD17B10HPGDALDH1A1TDP1
Aspirin SCHEMBL2993825 0.93 KDM4E (0.61) KDM4EHSD17B10HPGDALDH1A1TDP1
Aspirin SCHEMBL2993829 0.93 KDM4E (0.61) KDM4EHSD17B10HPGDALDH1A1TDP1
Aspirin SCHEMBL4094492 0.91 KDM4E (0.53) KDM4EHSD17B10HPGDALDH1A1TDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023131645-A1 IMPROVED SYNTHESIS OF LYSINE ACETYLSALICYLATE · GLYCINE PARTICLES ASPIAIR GMBH (DE) 2023-07-13 WO claimed
CN-110114333-B Improved synthesis of lysine acetylsalicylate glycine particles 阿斯皮亚尔股份有限公司 2022-12-02 CN claimed
EP-3558920-B1 IMPROVED SYNTHESIS OF LYSINE ACETYLSALICYLATE · GLYCINE PARTICLES ASPIAIR GMBH (DE) 2021-04-07 EP claimed
EP-3558920-A1 IMPROVED SYNTHESIS OF LYSINE ACETYLSALICYLATE · GLYCINE PARTICLES Ventaleon GmbH (DE) 2019-10-30 EP claimed
WO-2018115434-A1 IMPROVED SYNTHESIS OF LYSINE ACETYLSALICYLATE · GLYCINE PARTICLES VENTALEON GMBH (DE) 2018-06-28 WO claimed
WO-2023131645-A1 IMPROVED SYNTHESIS OF LYSINE ACETYLSALICYLATE · GLYCINE PARTICLES ASPIAIR GMBH (DE) 2023-07-13 WO disclosed
WO-2023131645-A1 IMPROVED SYNTHESIS OF LYSINE ACETYLSALICYLATE · GLYCINE PARTICLES ASPIAIR GMBH (DE) 2023-07-13 WO disclosed
CN-110114333-B Improved synthesis of lysine acetylsalicylate glycine particles 阿斯皮亚尔股份有限公司 2022-12-02 CN disclosed
CN-110114333-B Improved synthesis of lysine acetylsalicylate glycine particles 阿斯皮亚尔股份有限公司 2022-12-02 CN disclosed
CN-110114333-B Improved synthesis of lysine acetylsalicylate glycine particles 阿斯皮亚尔股份有限公司 2022-12-02 CN disclosed
EP-3558920-B1 IMPROVED SYNTHESIS OF LYSINE ACETYLSALICYLATE · GLYCINE PARTICLES ASPIAIR GMBH (DE) 2021-04-07 EP disclosed
US-10882811-B2 Synthesis of lysine acetylsalicylate glycine particles ASPIAIR GMBH (DE) 2021-01-05 US disclosed
WO-2018115434-A1 IMPROVED SYNTHESIS OF LYSINE ACETYLSALICYLATE · GLYCINE PARTICLES VENTALEON GMBH (DE) 2018-06-28 WO disclosed
WO-2018115434-A1 IMPROVED SYNTHESIS OF LYSINE ACETYLSALICYLATE · GLYCINE PARTICLES VENTALEON GMBH (DE) 2018-06-28 WO disclosed
WO-2017109037-A1 TREATMENT OF MODERATE TO SEVERE INFLUENZA VENTALEON GMBH (DE) 2017-06-29 WO disclosed
US-9492413-B2 Use of salt of an acetylsalicylic acid for the treatment of viral infections VENTALEON GMBH (DE) 2016-11-15 US disclosed
EP-2249866-B1 USE OF AN ACETYLSALICYLIC ACID SALT FOR THE TREATMENT OF VIRAL INFECTIONS ACTIVAERO GMBH (DE) 2012-08-15 EP disclosed
US-20120017892-A1 USE OF SALT OF AN ACETYLSALICYLIC ACID FOR THE TREATMENT OF VIRAL INFECTIONS ACTIVAERO GMBH (DE) 2012-01-26 US disclosed
EP-2249866-A2 USE OF AN ACETYLSALICYLIC ACID SALT FOR THE TREATMENT OF VIRAL INFECTIONS Activaero GmbH (DE) 2010-11-17 EP disclosed
WO-2009089822-A2 USE OF AN ACETYLSALICYLIC ACID SALT FOR THE TREATMENT OF VIRAL INFECTIONS ACTIVAERO GMBH (DE) 2009-07-23 WO disclosed