Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.46 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.46 |
| ▸ | KIF11 | P52732 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | CES1 | P23141 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL3664383 | 1.00 | CYP1A2 (0.46) | CYP1A2MEN1KMT2ASCN5ASCN9A | |
| SCHEMBL3664564 | 1.00 | CYP1A2 (0.46) | CYP1A2MEN1KMT2ASCN5ASCN9A | |
| SCHEMBL28416200 | 1.00 | CYP1A2 (0.46) | CYP1A2MEN1KMT2ASCN5ASCN9A | |
| SCHEMBL28419024 | 1.00 | CYP1A2 (0.46) | CYP1A2MEN1KMT2ASCN5ASCN9A | |
| SCHEMBL16586535 | 0.98 | CYP1A2 (0.47) | CYP1A2MEN1KMT2ASCN5ASCN9A | |
| SCHEMBL372366 | 0.93 | KIF11 (0.49) | CYP1A2MEN1KMT2ASCN5ASCN9A | |
| SCHEMBL1478852 | 0.86 | CYP1A2 (0.51) | CYP1A2MEN1KMT2AKIF11GAA | |
| SCHEMBL22326267 | 0.84 | CNR1 (0.45) | CYP1A2ALDH1A1HTT | |
| SCHEMBL28638861 | 0.83 | KIF11 (0.45) | CYP1A2SCN5ASCN9AKIF11GAA | |
| SCHEMBL7919119 | 0.83 | MEN1 (0.46) | CYP1A2MEN1KMT2AEPHX2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106749373-B | Rubber additive and preparation and application thereof | 同济大学 | 2020-06-26 | — | — | CN | disclosed |