Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | CDC25B | P30305 | 1/20 | 0.47 |
| ▸ | CASP6 | P55212 | 1/20 | 0.47 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10659876 | 0.85 | ALDH1A1 (0.44) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL11165456 | 0.82 | SKP2 (0.57) | ALDH1A1CDC25BCASP6RCE1HPGD | |
| SCHEMBL10660025 | 0.81 | SKP2 (0.51) | ALDH1A1KDM4EHSD17B10SKP2 | |
| SCHEMBL648210 | 0.81 | ALDH1A1 (0.72) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL11387602 | 0.79 | ALDH1A1 (0.45) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL20670595 | 0.77 | ALDH1A1 (0.54) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL4097033 | 0.77 | ALDH1A1 (0.54) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL10655549 | 0.77 | XDH (0.46) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL24629784 | 0.76 | ALDH1A1 (0.45) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL9041416 | 0.76 | ALDH1A1 (0.53) | ALDH1A1CDC25BCASP6RCE1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4745116-A | INHIBITORS OF SERINE PROTEASE | SYNTEX (U.S.A.) INC. (US) | 1988-05-17 | — | — | US | disclosed |
| US-4665070-A | SERINE PROTEINASE INHIBITORS | SYNTEX (U.S.A.) INC. (US) | 1987-05-12 | — | — | US | disclosed |
| EP-0206323-A1 | 2-Oxy-4H-3,1-benzoxazin-4-one derivatives and related compounds | SYNTEX (U.S.A.) INC. (US) | 1986-12-30 | — | — | EP | disclosed |