Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Alcohol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.30 |
| ▸ | THRA | P10827 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL10883935 | 0.93 | ALDH1A1 (0.37) | ALDH1A1KMT2AGAAHSD17B10NR1I2 | |
| SCHEMBL8827153 | 0.81 | CA2 (0.38) | ALDH1A1KMT2AGAAHSD17B10NR1I2 | |
| SCHEMBL10707508 | 0.80 | CA2 (0.37) | KMT2AGAAHSD17B10NR1I2CA2 | |
| SCHEMBL466268 | 0.79 | CYP3A4 (0.33) | ALDH1A1KMT2AGAAHSD17B10NR1I2 | |
| SCHEMBL6462701 | 0.77 | CA2 (0.34) | KMT2AGAAHSD17B10NR1I2CA2 | |
| SCHEMBL94853 | 0.76 | CA1 (0.32) | CA2CA4 | |
| SCHEMBL11407591 | 0.73 | THRA (0.46) | ALDH1A1KMT2ACA2MEN1TSHR | |
| SCHEMBL11540679 | 0.73 | KMT2A (0.38) | ALDH1A1KMT2AGAAHSD17B10NR1I2 | |
| SCHEMBL2290336 | 0.71 | THRA (0.47) | TSHRTHRATHRB | |
| SCHEMBL7922622 | 0.71 | THRB (0.38) | ALDH1A1HSD17B10CA2CA4TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0111789-A1 | Bis(beta-pentabromophenoxyethyl) succinate, a flame retardant for ABS | BORG-WARNER CHEMICALS INC. (US) | 1984-06-27 | — | — | EP | disclosed |