Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | TACR1 | P25103 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29419103 | 0.89 | ABCG2 (0.47) | ALDH1A1NTRK1TP53GAACHRM3 | |
| SCHEMBL121792 | 0.89 | ABCG2 (0.47) | ALDH1A1NTRK1TP53GAACHRM3 | |
| SCHEMBL1877272 | 0.87 | NTRK1 (0.49) | ALDH1A1SMN1; SMN2NTRK1TP53KMT2A | |
| SCHEMBL13064249 | 0.86 | TSHR (0.50) | ALDH1A1NTRK1GAAKMT2AMAPT | |
| SCHEMBL13210784 | 0.86 | KMT2A (0.42) | SMN1; SMN2TP53GAACHRM3KMT2A | |
| SCHEMBL4106877 | 0.85 | NTRK1 (0.40) | ALDH1A1SMN1; SMN2NTRK1TP53CHRM3 | |
| SCHEMBL27833840 | 0.83 | KMT2A (0.42) | ALDH1A1SMN1; SMN2NTRK1KMT2AMAPT | |
| SCHEMBL1044642 | 0.81 | MAPT (0.45) | ALDH1A1SMN1; SMN2GAAKMT2AMAPT | |
| SCHEMBL13210721 | 0.81 | NTRK1 (0.43) | ALDH1A1SMN1; SMN2THRBNTRK1CHRM3 | |
| SCHEMBL12212662 | 0.81 | MAPT (0.43) | ALDH1A1SMN1; SMN2TP53GAAKMT2A |
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-2220938-A2 | Synergistic fungicidal combinations | Bayer CropScience AG (DE) | 2010-08-25 | — | — | EP | disclosed |