Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6565744 | 0.84 | GAA (0.46) | HPGDCYP3A4CYP2C19RAB9AKMT2A | |
| Isopropylbenzene SCHEMBL6568803 | 0.81 | GAA (0.48) | HPGDCYP3A4CYP2C19RAB9ASIGMAR1 | |
| Benzene SCHEMBL5290987 | 0.80 | TAAR1 (0.61) | TAAR1TRPA1ALDH1A1 | |
| SCHEMBL136376 | 0.80 | TAAR1 (0.61) | TAAR1TRPA1ALDH1A1 | |
| SCHEMBL17453236 | 0.80 | TAAR1 (0.61) | TAAR1TRPA1ALDH1A1 | |
| SCHEMBL4443642 | 0.80 | TAAR1 (0.61) | TAAR1TRPA1ALDH1A1 | |
| SCHEMBL9028373 | 0.79 | GAA (0.47) | SIGMAR1GAAL3MBTL1KDM4EALDH1A1 | |
| Hydrogen Peroxide SCHEMBL190109 | 0.78 | TRPA1 (0.61) | KMT2ATAAR1TRPA1ALDH1A1 | |
| SCHEMBL31498533 | 0.78 | TAAR1 (0.58) | TAAR1TRPA1ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL6014467 | 0.78 | TAAR1 (0.58) | TAAR1TRPA1ALDH1A1 |
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-1402524-A2 | SOLVENT COMPOSITION AND PROCESS FOR MANUFACTURING AN OPTICAL RECORDING MEDIUM USING SAID COMPOSITION AND OPTICAL RECORDING MEDIUM | Ciba SC Holding AG (CH) | 2004-03-31 | — | — | EP | disclosed |
| WO-2003034146-A2 | SOLVENT COMPOSITION AND PROCESS FOR MANUFACTURING AN OPTICAL RECORDING MEDIUM USING SAID COMPOSITION AND OPTICAL RECORDING MEDIUM | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2003-04-24 | — | — | WO | disclosed |