Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 4/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.61 |
| ▸ | GLA | P06280 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8982554 | 0.88 | KDM4E (0.63) | HPRT1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL6746219 | 0.88 | ALDH1A1 (0.59) | HPRT1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL11662670 | 0.84 | HPRT1 (0.62) | HPRT1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL31154593 | 0.81 | ALDH1A1 (0.58) | HPRT1ALDH1A1KDM4EGLAGAA | |
| SCHEMBL6138266 | 0.80 | MAPT (0.60) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL6746166 | 0.78 | MAPT (0.62) | ALDH1A1KDM4EGLAGAAHPGD | |
| Chrysene SCHEMBL28443586 | 0.78 | HPRT1 (0.70) | HPRT1ALDH1A1HPGDMAPTCYP1A2 | |
| SCHEMBL20436327 | 0.77 | ALDH1A1 (0.57) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL357522 | 0.77 | KDM4E (0.69) | ALDH1A1KDM4EGAAHPGDMAPT | |
| SCHEMBL29514721 | 0.77 | KDM4E (0.69) | ALDH1A1KDM4EGAAHPGDMAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1124552-A4 | ANTITUMOR CHRYSENE DERIVATIVES | REGENTS BOARD OF (US) | 2005-01-05 | — | — | EP | disclosed |
| EP-1124552-A1 | ANTITUMOR CHRYSENE DERIVATIVES | THE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2001-08-22 | — | — | EP | disclosed |
| WO-2000024394-A1 | ANTITUMOR CHRYSENE DERIVATIVES | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2000-05-04 | — | — | WO | disclosed |
| US-6015811-A | Antitumor Chrysene derivatives | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2000-01-18 | — | — | US | disclosed |