Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.32 |
| ▸ | CYP2E1 | P05181 | 4/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.32 |
| ▸ | CYP2C8 | P10632 | 4/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.32 |
| ▸ | CYP2B6 | P20813 | 4/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18757924 | 0.74 | NUDT1 (0.38) | CYP1A2HPGD | |
| SCHEMBL9705260 | 0.72 | NOS1 (0.45) | CYP2C9 | |
| SCHEMBL27573343 | 0.71 | PI4KA (0.45) | — | |
| SCHEMBL18785838 | 0.71 | KMT2A (0.36) | CYP1A2CYP2E1CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL18786068 | 0.70 | PI4KA (0.44) | — | |
| SCHEMBL18757838 | 0.66 | SMN1; SMN2 (0.43) | CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7175004 | 0.62 | TP53 (0.32) | CYP3A4TSHR | |
| SCHEMBL11290088 | 0.60 | ALOX5 (0.36) | ALOX5PPARG | |
| SCHEMBL1398871 | 0.58 | ALDH1A1 (0.53) | CYP1A2HPGD | |
| SCHEMBL10690472 | 0.58 | PDE2A (0.43) | CYP1A2HPGD |
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-3362100-B1 | HINDERED DISULFIDE DRUG CONJUGATES | GENENTECH INC (US) | 2022-06-22 | — | — | EP | disclosed |