Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK3 | P07288 | 6/20 | 0.56 |
| ▸ | F2 | P00734 | 6/20 | 0.46 |
| ▸ | F12 | P00748 | 5/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | KLK7 | P49862 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.40 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.40 |
| ▸ | KLK1 | P06870 | 1/20 | 0.40 |
| ▸ | KLK14 | Q9P0G3 | 1/20 | 0.40 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 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 | |
|---|---|---|---|---|
| SCHEMBL2571839 | 0.81 | KLK3 (0.66) | KLK3F2F12KLK7MAPT | |
| SCHEMBL14688829 | 0.79 | F2 (0.55) | F2POLBMAPTKMT2AKLKB1 | |
| SCHEMBL2567843 | 0.79 | KLK3 (0.67) | KLK3F2F12KLK7MAPT | |
| SCHEMBL2568841 | 0.79 | KLK3 (0.64) | KLK3F2F12KLK7MAPT | |
| SCHEMBL2552639 | 0.70 | MAPT (0.78) | F2POLBMAPTKMT2AKLKB1 | |
| SCHEMBL2689845 | 0.70 | CYP2A6 (0.54) | KLK3ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL2565569 | 0.69 | F2 (0.48) | KLK3F2F12MAPTKMT2A | |
| SCHEMBL2568614 | 0.69 | F2 (0.54) | F2POLBMAPTKLKB1KLK1 | |
| SCHEMBL2551230 | 0.68 | KLK3 (0.52) | KLK3F2F12MAPTKMT2A | |
| SCHEMBL30165671 | 0.67 | CYP2A6 (0.50) | POLBMAPTKMT2AALDH1A1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2560966-A2 | MULTISUBSTITUTED AROMATIC COMPOUNDS AS INHIBITORS OF THROMBIN | Verseon Corporation (US) | 2013-02-27 | — | — | EP | disclosed |
| WO-2011126903-A2 | MULTISUBSTITUTED AROMATIC COMPOUNDS AS INHIBITORS OF THROMBIN | VERSEON, INC. (US) | 2011-10-13 | — | — | WO | disclosed |