Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acetone. 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 | |
|---|---|---|---|---|
| ▸ | MME | P08473 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MGAM | O43451 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | SI | P14410 | 2/20 | 0.31 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.31 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 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 | |
|---|---|---|---|---|
| Alcohol SCHEMBL5065734 | 0.92 | MME (0.37) | MMECA1CA2SMN1; SMN2ZDHHC7 | |
| SCHEMBL27468576 | 0.81 | MME (0.46) | MMECA1CA2SMN1; SMN2ZDHHC7 | |
| SCHEMBL222338 | 0.79 | SMN1; SMN2 (0.44) | MMECA1CA2SMN1; SMN2ZDHHC7 | |
| SCHEMBL17066375 | 0.77 | ALDH1A1 (0.46) | ALDH1A1LMNAHSD17B10MEN1TSHR | |
| SCHEMBL13751258 | 0.77 | SMN1; SMN2 (0.40) | MMECA1CA2SMN1; SMN2ZDHHC7 | |
| SCHEMBL4771674 | 0.76 | CA1 (0.45) | MMECA1CA2SMN1; SMN2ZDHHC7 | |
| SCHEMBL28571454 | 0.76 | MME (0.40) | MMECA1CA2SMN1; SMN2ZDHHC7 | |
| SCHEMBL27600925 | 0.74 | CA1 (0.39) | MMECA1CA2SMN1; SMN2ZDHHC7 | |
| SCHEMBL25457592 | 0.73 | ALDH1A1 (0.40) | MMECA1CA2SMN1; SMN2ZDHHC7 | |
| SCHEMBL10914196 | 0.73 | SMN1; SMN2 (0.37) | MMECA1CA2SMN1; SMN2ZDHHC7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1697774-A1 | POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY | Fuji Photo Film Co., Ltd. (JP) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005064369-A1 | POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY | FUJI PHOTO FILM CO., LTD. (JP) | 2005-07-14 | — | — | WO | disclosed |