Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 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 | |
|---|---|---|---|---|
| SCHEMBL17839910 | 0.91 | ALDH1A1 (0.49) | ALDH1A1HPGDTSHRMAPK1MAPT | |
| SCHEMBL29394827 | 0.85 | SMN1; SMN2 (0.49) | ALDH1A1HPGDTSHRMAPK1MAPT | |
| SCHEMBL76069 | 0.85 | SMN1; SMN2 (0.49) | ALDH1A1HPGDTSHRMAPK1MAPT | |
| SCHEMBL1188683 | 0.83 | SMN1; SMN2 (0.42) | ALDH1A1HPGDTSHRMAPK1MAPT | |
| SCHEMBL17391071 | 0.82 | ALDH1A1 (0.48) | ALDH1A1HPGDTSHRMAPK1MAPT | |
| SCHEMBL1058740 | 0.81 | ALDH1A1 (0.51) | ALDH1A1HPGDTSHRMAPK1MAPT | |
| SCHEMBL757021 | 0.81 | ALDH1A1 (0.56) | ALDH1A1HPGDTSHRMAPK1MAPT | |
| SCHEMBL17973539 | 0.78 | ALDH1A1 (0.48) | ALDH1A1HPGDTSHRMAPK1MAPT | |
| SCHEMBL30861605 | 0.76 | MEN1 (0.52) | ALDH1A1HPGDTSHRMAPK1MAPT | |
| SCHEMBL22597948 | 0.75 | POLB (0.43) | ALDH1A1HPGDTSHRKDM4ELMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-9572802-B2 | Diamide compounds having muscarinic receptor antagonist and β2 adrenergic receptor agonist activity | THERAVANCE RESPIRATORY COMPANY LLC (US) | 2017-02-21 | — | — | US | disclosed |