Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.40 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28883377 | 0.76 | SSTR4 (0.41) | TDP1MAPTPKMCYP2D6CYP1A2 | |
| SCHEMBL29207386 | 0.72 | ADRA2A (0.51) | MAPTCYP2D6CYP1A2CYP2C19MAPK1 | |
| SCHEMBL5008796 | 0.71 | TDP1 (0.59) | TDP1CYP2D6CYP1A2CYP2C19LMNA | |
| SCHEMBL7617976 | 0.71 | TDP1 (0.55) | TDP1CYP2D6CYP1A2CYP2C19LMNA | |
| SCHEMBL1692324 | 0.70 | MTNR1A (0.36) | MAPTCYP2D6CYP1A2MAPK1LMNA | |
| SCHEMBL28688898 | 0.70 | CDC25B (0.49) | TDP1MAPTLMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL269372 | 0.69 | TDP1 (0.62) | TDP1CYP2D6CYP1A2CYP2C19SIRT5 | |
| SCHEMBL5831206 | 0.67 | CYP2C19 (0.59) | TDP1CYP2D6CYP1A2CYP2C19LMNA | |
| SCHEMBL6027916 | 0.67 | TDP1 (0.58) | TDP1MAPTCYP2D6CYP1A2CYP2C19 | |
| SCHEMBL266575 | 0.67 | TDP1 (0.69) | TDP1CYP2D6CYP1A2CYP2C19SIRT5 |
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-0607334-B1 | CYCLIC UREAS AND ANALOGUES USEFUL AS RETROVIRAL PROTEASE INHIBITIORS | DU PONT MERCK PHARMA (US) | 1997-07-30 | — | — | EP | claimed |