Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 4/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8080769 | 0.79 | TLR2 (0.45) | CTSKJAK3BTK | |
| Lysine SCHEMBL11590831 | 0.76 | ALDH1A1 (0.42) | ALDH1A1TSHRCTSKCYP1A2CYP3A4 | |
| SCHEMBL7993210 | 0.75 | TPSAB1 (0.43) | ALDH1A1CTSKCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8297502 | 0.75 | TPSAB1 (0.43) | ALDH1A1CTSKCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29280233 | 0.75 | TPSAB1 (0.43) | ALDH1A1CTSKCYP1A2CYP3A4CYP2D6 | |
| Lysine SCHEMBL11725815 | 0.73 | CPB1 (0.48) | ALDH1A1TSHR | |
| SCHEMBL972564 | 0.72 | CTSK (0.47) | CTSKJAK3BTKCTSS | |
| SCHEMBL31192697 | 0.71 | CYP1A2 (0.51) | CYP1A2CYP3A4CYP2D6CYP2C9HPGD | |
| SCHEMBL5497442 | 0.71 | CYP1A2 (0.51) | CYP1A2CYP3A4CYP2D6CYP2C9HPGD | |
| SCHEMBL1938311 | 0.71 | CYP1A2 (0.51) | CYP1A2CYP3A4CYP2D6CYP2C9HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004001055-A2 | PNA PRODRUGS | SANTARIS PHARMA A/S (DK) | 2003-12-31 | — | — | WO | disclosed |