Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | CES2 | O00748 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CDC25B | P30305 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27926228 | 0.92 | ALDH1A1 (0.61) | ALDH1A1CES2MAPK1CES1MAPT | |
| SCHEMBL27726293 | 0.85 | ALDH1A1 (0.49) | ALDH1A1CES2MAPK1CES1MAPT | |
| SCHEMBL28746583 | 0.85 | ALDH1A1 (0.49) | ALDH1A1CES2MAPK1CES1MAPT | |
| Furan SCHEMBL28153012 | 0.84 | ALDH1A1 (0.60) | ALDH1A1CES2MAPK1CES1MAPT | |
| SCHEMBL27473292 | 0.83 | CTSD (0.50) | ALDH1A1MAPK1MAPTHTTVCAM1 | |
| SCHEMBL27495266 | 0.82 | ALDH1A1 (0.57) | ALDH1A1CES2MAPK1CES1MAPT | |
| SCHEMBL28075865 | 0.82 | ALDH1A1 (0.48) | ALDH1A1CES2MAPK1CES1MAPT | |
| SCHEMBL17009646 | 0.81 | CES2 (0.61) | ALDH1A1CES2MAPK1CES1MAPT | |
| SCHEMBL27926097 | 0.80 | ALDH1A1 (0.58) | ALDH1A1CES2MAPK1CES1MAPT | |
| SCHEMBL28066803 | 0.79 | ALDH1A1 (0.68) | ALDH1A1CES2MAPK1CES1MAPT |
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-107286090-A | A kind of preparation method of 6,7- dimethyl -4- oxyquinolines | 湖南华腾制药有限公司 | 2017-10-24 | — | — | CN | disclosed |