Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.71 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.71 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.71 |
| ▸ | POLB | P06746 | 1/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL17131827 | 0.84 | ALDH1A1 (0.65) | ALDH1A1CYP3A4CYP2D6CYP2C19POLB | |
| SCHEMBL2974373 | 0.84 | CYP3A4 (0.97) | ALDH1A1CYP3A4CYP2D6CYP2C19POLB | |
| SCHEMBL29223990 | 0.80 | CYP2D6 (0.64) | ALDH1A1CYP3A4CYP2D6CYP2C19POLB | |
| SCHEMBL30095942 | 0.80 | CYP2D6 (0.64) | ALDH1A1CYP3A4CYP2D6CYP2C19POLB | |
| SCHEMBL1038510 | 0.79 | ALDH1A1 (0.57) | ALDH1A1CYP3A4CYP2D6CYP2C19POLB | |
| SCHEMBL10413301 | 0.76 | CYP2C19 (0.54) | ALDH1A1CYP3A4CYP2D6CYP2C19POLB | |
| SCHEMBL10045223 | 0.76 | CYP3A4 (0.63) | ALDH1A1CYP3A4CYP2D6CYP2C19POLB | |
| Benzene SCHEMBL11697595 | 0.74 | MEN1 (0.78) | CYP3A4MEN1KMT2AMAPTTDP1 | |
| SCHEMBL1654 | 0.74 | MEN1 (0.78) | CYP3A4MEN1KMT2AMAPTTDP1 | |
| SCHEMBL5799878 | 0.74 | MEN1 (0.78) | CYP3A4MEN1KMT2AMAPTTDP1 |
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-0005014-A1 | Clavulanic acid derivatives, preparation and compositions | BEECHAM GROUP PLC (GB) | 1979-10-31 | — | — | EP | disclosed |