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)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 5/20 | 0.69 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.69 |
| ▸ | TSHR | P16473 | 5/20 | 0.69 |
| ▸ | LMNA | P02545 | 2/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.69 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.69 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.69 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.69 |
| ▸ | ESR1 | P03372 | 2/20 | 0.69 |
| ▸ | SLC22A6 | Q4U2R8 | 2/20 | 0.69 |
| ▸ | ALB | P02768 | 1/20 | 0.69 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.69 |
| ▸ | RARB | P10826 | 1/20 | 0.69 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.69 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.69 |
| ▸ | HTR2A | P28223 | 1/20 | 0.69 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.69 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.69 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.69 |
| ▸ | BLM | P54132 | 1/20 | 0.69 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Palmitic Acid SCHEMBL7702151 | 1.00 | PTGS1 (0.69) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| Oleic Acid SCHEMBL12470952 | 0.93 | PTGS1 (0.59) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| Ibuprofen SCHEMBL9302599 | 0.91 | PTGS1 (0.83) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| Linoleic Acid SCHEMBL12471256 | 0.91 | ALDH1A1 (0.59) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| Ibuprofen SCHEMBL3428176 | 0.88 | PTGS1 (0.68) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| Ibuprofen SCHEMBL942351 | 0.87 | PTGS1 (0.86) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| Ibuprofen SCHEMBL28512825 | 0.86 | PTGS1 (0.69) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| Ibuprofen SCHEMBL17782137 | 0.86 | PTGS1 (0.69) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| Ibuprofen SCHEMBL9419500 | 0.86 | PTGS1 (0.69) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| Dexibuprofen SCHEMBL8853210 | 0.86 | PTGS1 (0.69) | PTGS1PTGS2TSHRLMNACYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2673370-A1 | PRODUCTION OF ALCOHOL ESTERS IN SITU USING ALCOHOLS AND FATTY ACIDS PRODUCED BY MICROORGANISMS | E.I. Du Pont De Nemours And Company (US) | 2013-12-18 | — | — | EP | disclosed |
| US-20130040340-A1 | PRODUCTION OF ALCOHOL ESTERS IN SITU USING ALCOHOLS AND FATTY ACIDS PRODUCED BY MICROORGANISMS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2013-02-14 | — | — | US | disclosed |
| WO-2012109221-A1 | PRODUCTION OF ALCOHOL ESTERS IN SITU USING ALCOHOLS AND FATTY ACIDS PRODUCED BY MICROORGANISMS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-08-16 | — | — | WO | disclosed |