Stearic Acid

Stearic Acid

SCHEMBL9769935

CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCc1cccc(C(=O)[O-])c1O.[Al+2]

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

rplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Stearic Acid. 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
BID P55957 3/20 0.44
MCL1 Q07820 3/20 0.44
BCL2L1 Q07817 2/20 0.44
BAK1 Q16611 2/20 0.44
KAT8 Q9H7Z6 2/20 0.44
IAPP P10997 1/20 0.44
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
EP300 Q09472 1/20 0.44
KAT2A Q92830 1/20 0.44
KAT2B Q92831 1/20 0.44
KAT5 Q92993 1/20 0.44
SAE1 Q9UBE0 1/20 0.44
ALOX5 P09917 1/20 0.43
PTGS2 P35354 1/20 0.43
FABP3 P05413 4/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41

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
Stearic Acid SCHEMBL9769931 0.88 HMGB1 (0.50) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL11169533 0.88 BID (0.52) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL31372911 0.88 BID (0.52) BIDMCL1BCL2L1BAK1KAT8
Zinc Ion SCHEMBL10581371 0.88 BID (0.52) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL11123537 0.88 BID (0.52) BIDMCL1BCL2L1BAK1KAT8
Zinc Ion SCHEMBL10584384 0.88 BID (0.52) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL11125907 0.88 BID (0.52) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL3517528 0.88 BID (0.52) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9790326 0.88 BID (0.52) BIDMCL1BCL2L1BAK1KAT8
Zinc Ion SCHEMBL7084049 0.88 BID (0.52) BIDMCL1BCL2L1BAK1KAT8

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5013833-A Process for preparing cefuroxime axetil GLAXO GROUP LIMITED (GB) 1991-05-07 US disclosed
US-4994567-A Purification by recovering from solution by roller drying GALAXO GROUP LIMITED (GB) 1991-02-19 US disclosed
US-4820833-A PURIFICATION BY SPRAY DRYING PRECIPITATION, FREEZE DRYING; CEPHALOSPORINS GLAXO GROUP LIMITED (GB) 1989-04-11 US disclosed
EP-0107276-B1 NOVEL FORM OF CEFUROXIME ESTER, PROCESS FOR ITS PREPARATION AND COMPOSITION CONTAINING IT GLAXO GROUP LIMITED (GB) 1987-10-07 EP disclosed
US-4562181-A INCREASED ABSORPTION VIA THE GASTROINTESTINAL TRACT, ALLOWING FOR ORAL OR RECTAL ADMINISTRATION GLAXO GROUP LIMITED (GB) 1985-12-31 US disclosed
EP-0107276-A2 Novel form of cefuroxime ester, process for its preparation and composition containing it GLAXO GROUP LIMITED (GB) 1984-05-02 EP disclosed