Guaiazulene Sulfonic Acid

Guaiazulene Sulfonic Acid

SCHEMBL9065336

Cc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2.[NaH]

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
PTGS1 P23219 2/20 0.43
TRPA1 O75762 1/20 0.43
CACNA1C Q13936 1/20 0.43
ACHE P22303 4/20 0.38
BCHE P06276 3/20 0.38
FABP3 P05413 1/20 0.38
FABP4 P15090 1/20 0.38
FABP5 Q01469 1/20 0.38
ALDH1A1 P00352 3/20 0.35
HTT P42858 2/20 0.35
ALOX12 P18054 2/20 0.35
GAA P10253 1/20 0.35
HIF1A Q16665 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
IDH1 O75874 1/20 0.34
PTGS2 P35354 1/20 0.34
RNASEH1 O60930 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33

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
Guaiazulene Sulfonic Acid SCHEMBL2734180 0.98 LMNA (0.46) LMNAPTGS1TRPA1CACNA1CACHE
Guaiazulene Sulfonic Acid SCHEMBL31632205 0.98 LMNA (0.46) LMNAPTGS1TRPA1CACNA1CACHE
Guaiazulene Sulfonic Acid SCHEMBL1648769 0.81 LMNA (0.44) LMNAPTGS1TRPA1CACNA1CALDH1A1
Guaiazulene Sulfonic Acid SCHEMBL29611830 0.81 LMNA (0.44) LMNAPTGS1TRPA1CACNA1CALDH1A1
SCHEMBL10909581 0.81 LMNA (0.47) LMNAPTGS1TRPA1CACNA1CACHE
SCHEMBL10805823 0.80 LMNA (0.43) LMNAPTGS1TRPA1CACNA1CACHE
SCHEMBL15878620 0.80 ACHE (0.49) LMNAPTGS1TRPA1CACNA1CACHE
Guaiazulene Sulfonic Acid SCHEMBL28273542 0.80 LMNA (0.43) LMNAPTGS1TRPA1CACNA1CACHE
SCHEMBL393740 0.80 PTGS1 (0.52) LMNAPTGS1TRPA1CACNA1CACHE
SCHEMBL30026088 0.80 PTGS1 (0.52) LMNAPTGS1TRPA1CACNA1CACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114642685-A Antibacterial and anti-inflammatory female intimate probiotic composition and preparation thereof 王飞 2022-06-21 CN claimed
CN-112438997-A Effervescent tablet for self-made nasal spray 北京瑞尚天启科技有限公司 2021-03-05 CN claimed
CN-112089680-A Effervescent tablet for self-made mouthwash 王飞 2020-12-18 CN claimed
CN-111973636-A Anorectal gel and preparation method thereof 王飞 2020-11-24 CN claimed
CN-111632073-A Antibacterial and anti-inflammatory female privates probiotic composition and preparation thereof 王飞 2020-09-08 CN claimed
CN-111631991-A Private nursing lotion 王飞 2020-09-08 CN claimed
JP-2115121-A None JP disclosed
JP-56030927-A None JP disclosed
JP-63139118-A None JP disclosed
CN-114642685-A Antibacterial and anti-inflammatory female intimate probiotic composition and preparation thereof 王飞 2022-06-21 CN disclosed
CN-114452379-A Probiotic composition containing active lactic acid and preparation method thereof 西安正浩生物制药有限公司 2022-05-10 CN disclosed
CN-112438997-A Effervescent tablet for self-made nasal spray 北京瑞尚天启科技有限公司 2021-03-05 CN disclosed
CN-112089680-A Effervescent tablet for self-made mouthwash 王飞 2020-12-18 CN disclosed
CN-111631991-A Private nursing lotion 王飞 2020-09-08 CN disclosed
CN-111067858-A Skin care powder 王飞 2020-04-28 CN disclosed
CN-108310389-A One kind pro-drug of sodium sulfonate containing Kessazulen and preparation method thereof 佛山科学技术学院 2018-07-24 CN disclosed
WO-1996025158-A1 MEDICINAL COMPOSITION CONTAINING AZULENE DERIVATIVE AND PROCESS FOR PRODUCING THE SAME YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1996-08-22 WO disclosed
JP-H02115121-A ANTAGONIST AGAINST THRONBOXANE A2 AND PROSTAGLANDIN ENDOPEROXIDE KOTOBUKI SEIYAKU KK 1990-04-27 JP disclosed
JP-S63139118-A INTRAORAL CLEANING AGENT NISSHIN KORYO KK 1988-06-10 JP disclosed
JP-S5630927-A STABILIZATION OF GUAIAZULENE AND ITS DERIVATIVE ZERIA SHINYAKU KOGYO KK 1981-03-28 JP disclosed