Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28747375 | 0.85 | ALDH1A1 (0.53) | ALDH1A1HPGDTSHRHSP90AA1SMN1; SMN2 | |
| SCHEMBL9644178 | 0.84 | ALDH1A1 (0.52) | ALDH1A1HPGDTSHRHSP90AA1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL9643719 | 0.82 | ALDH1A1 (0.50) | ALDH1A1HPGDTSHRHSP90AA1SMN1; SMN2 | |
| SCHEMBL18792363 | 0.82 | ALDH1A1 (0.50) | ALDH1A1HPGDTSHRHSP90AA1SMN1; SMN2 | |
| SCHEMBL9642790 | 0.79 | ALDH1A1 (0.55) | ALDH1A1HPGDTSHRHSP90AA1SMN1; SMN2 | |
| SCHEMBL20503252 | 0.79 | ALDH1A1 (0.47) | ALDH1A1HPGDTSHRHSP90AA1SMN1; SMN2 | |
| SCHEMBL20503273 | 0.78 | GPR35 (0.47) | ALDH1A1HPGDTSHRHSP90AA1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL9642771 | 0.78 | ALDH1A1 (0.53) | ALDH1A1HPGDTSHRHSP90AA1SMN1; SMN2 | |
| SCHEMBL9642929 | 0.78 | ALDH1A1 (0.58) | ALDH1A1HPGDTSHRHSP90AA1SMN1; SMN2 | |
| SCHEMBL4165757 | 0.76 | ALDH1A1 (0.52) | ALDH1A1HPGDSMN1; SMN2KDM4ERAB9A |
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-2427447-A2 | SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION | Pike Pharma GmbH (CH) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010128163-A2 | SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION | PIKE PHARMA GMBH (CH) | 2010-11-11 | — | — | WO | disclosed |