Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10957143 | 0.87 | CYP3A4 (0.46) | CYP3A4ALDH1A1TSHR | |
| SCHEMBL13854643 | 0.79 | CYP3A4 (0.34) | CYP3A4ALDH1A1TSHR | |
| SCHEMBL343453 | 0.79 | CYP3A4 (0.46) | CYP3A4ALDH1A1TSHR | |
| SCHEMBL12786038 | 0.75 | — | — | |
| SCHEMBL13141361 | 0.74 | TDP1 (0.40) | CYP3A4 | |
| SCHEMBL17036883 | 0.74 | CYP2C19 (0.38) | CYP3A4 | |
| SCHEMBL11908183 | 0.74 | CYP3A4 (0.42) | CYP3A4ALDH1A1TSHR | |
| SCHEMBL13224500 | 0.74 | CYP3A4 (0.55) | CYP3A4ALDH1A1TSHR | |
| SCHEMBL575659 | 0.72 | CYP3A4 (0.52) | CYP3A4ALDH1A1TSHR | |
| SCHEMBL117709 | 0.71 | MEN1 (0.42) | CYP3A4ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-102574989-B | Polymer purification method and polymer | MITSUI CHEMICALS INC | 2014-03-26 | — | — | CN | disclosed |
| US-8450440-B2 | Method for purifying polymer and polymer | MITSUI CHEMICALS, INC. (JP) | 2013-05-28 | — | — | US | disclosed |
| US-20120208976-A1 | METHOD FOR PURIFYING POLYMER AND POLYMER | MITSUI CHEMICALS, INC (JP) | 2012-08-16 | — | — | US | disclosed |