Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 11/20 | 0.57 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.40 |
| ▸ | CDC25A | P30304 | 2/20 | 0.38 |
| ▸ | CDC25B | P30305 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.37 |
| ▸ | GMNN | O75496 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 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 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13049663 | 0.89 | APEX1 (0.71) | APEX1HSP90AA1HSP90AB1CDC25ACDC25B | |
| SCHEMBL13049412 | 0.89 | APEX1 (0.71) | APEX1HSP90AA1HSP90AB1CDC25ACDC25B | |
| SCHEMBL13894618 | 0.85 | APEX1 (0.78) | APEX1HSP90AA1HSP90AB1ALDH1A1MAPT | |
| SCHEMBL13894584 | 0.85 | APEX1 (0.78) | APEX1HSP90AA1HSP90AB1ALDH1A1MAPT | |
| SCHEMBL20123229 | 0.84 | APEX1 (0.57) | APEX1HSP90AA1HSP90AB1CDC25ACDC25B | |
| SCHEMBL13894616 | 0.80 | APEX1 (0.84) | APEX1HSP90AA1HSP90AB1CDC25ACDC25B | |
| SCHEMBL16938348 | 0.75 | APEX1 (0.66) | APEX1HSP90AA1HSP90AB1ALDH1A1MAPT | |
| SCHEMBL3745788 | 0.73 | APEX1 (1.00) | APEX1HSP90AA1HSP90AB1CDC25AALDH1A1 | |
| SCHEMBL3743461 | 0.73 | APEX1 (1.00) | APEX1HSP90AA1HSP90AB1CDC25AALDH1A1 | |
| SCHEMBL3743465 | 0.73 | APEX1 (1.00) | APEX1HSP90AA1HSP90AB1CDC25AALDH1A1 |
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-2009042544-A1 | QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF | INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) | 2009-04-02 | — | — | WO | disclosed |