Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | SETDB1 | Q15047 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14222335 | 0.81 | TAAR1 (0.41) | TAAR1ALDH1A1MAPTPOLBPYCR1 | |
| SCHEMBL8365116 | 0.80 | SMN1; SMN2 (0.41) | ALDH1A1MAPTTP53POLBFFAR4 | |
| SCHEMBL29781225 | 0.79 | TAAR1 (0.39) | TAAR1ALDH1A1MAPTFFAR4PYCR1 | |
| SCHEMBL4951267 | 0.79 | PYCR1 (0.45) | TAAR1ALDH1A1MAPTTP53POLB | |
| SCHEMBL3406483 | 0.79 | TAAR1 (0.39) | TAAR1ALDH1A1MAPTFFAR4PYCR1 | |
| SCHEMBL6911967 | 0.79 | TAAR1 (0.64) | TAAR1ALDH1A1MAPK1 | |
| SCHEMBL8045934 | 0.78 | TAAR1 (0.63) | TAAR1ALDH1A1MAPTTP53POLB | |
| Hydrochloric Acid SCHEMBL18524130 | 0.78 | TAAR1 (0.62) | TAAR1MAPTPOLBMEN1KMT2A | |
| SCHEMBL21985350 | 0.78 | SKP2 (0.43) | TAAR1ALDH1A1MAPTTP53MEN1 | |
| SCHEMBL15197151 | 0.76 | KDM4E (0.38) | TAAR1ALDH1A1MAPTFFAR4KMT2A |
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-2260032-A2 | FUNGICIDAL HETERCYCLIC COMPOUNDS | E. I. du Pont de Nemours and Company (US) | 2010-12-15 | — | — | EP | disclosed |
| WO-2009094445-A2 | FUNGICIDAL HETERCYCLIC COMPOUNDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2009-07-30 | — | — | WO | disclosed |