Known targets — ChEMBL curated mechanism
GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 6/20 | 0.32 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.31 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.31 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11660899 | 0.86 | — | — | |
| SCHEMBL4412214 | 0.78 | GAA (0.36) | GAAACHEGPR84FFAR1FFAR4 | |
| SCHEMBL305414 | 0.78 | GAA (0.36) | GAAACHEGPR84FFAR1FFAR4 | |
| SCHEMBL27952967 | 0.76 | GAA (0.35) | GAAACHEGPR84FFAR1FFAR4 | |
| SCHEMBL28716831 | 0.76 | GAA (0.35) | GAAACHEGPR84FFAR1FFAR4 | |
| SCHEMBL12835428 | 0.76 | GAA (0.35) | GAAACHEGPR84FFAR1FFAR4 | |
| SCHEMBL2436695 | 0.75 | GAA (0.33) | GAAACHEGPR84FFAR1FFAR4 | |
| SCHEMBL7064008 | 0.75 | — | — | |
| SCHEMBL31487823 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL29138748 | 0.75 | ALDH1A1 (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4775497-A | OXIDATION RESISTANCE, DISCOLORATION INHIBITION, AND STORAGE ST ABILITY | CIBA-GEIGY CORPORATION (US) | 1988-10-04 | — | — | US | disclosed |
| US-4775497-A | OXIDATION RESISTANCE, DISCOLORATION INHIBITION, AND STORAGE ST ABILITY | CIBA-GEIGY CORPORATION (US) | 1988-10-04 | — | — | US | disclosed |