Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL11390732 | 0.87 | CYP3A4 (0.36) | LRRK2ALDH1A1HPGDKMT2AMAPT | |
| SCHEMBL11379328 | 0.85 | LMNA (0.34) | LRRK2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL11460779 | 0.83 | GAA (0.52) | ALDH1A1HPGDGAAHTTKMT2A | |
| SCHEMBL11379334 | 0.82 | LMNA (0.34) | LRRK2ALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL11377779 | 0.81 | ALDH1A1 (0.43) | LRRK2ALDH1A1HPGDGAAKMT2A | |
| SCHEMBL10370702 | 0.79 | KDM4E (0.43) | ALDH1A1HPGDGAAHTTKMT2A | |
| SCHEMBL10470722 | 0.78 | GAA (0.56) | ALDH1A1HPGDGAAHTTKMT2A | |
| SCHEMBL24453346 | 0.77 | APLNR (0.39) | ALDH1A1HPGDGAAKMT2AMAPT | |
| SCHEMBL11378705 | 0.75 | PLAU (0.38) | ALDH1A1HPGDGAAHTTKMT2A | |
| SCHEMBL11393916 | 0.73 | KMT2A (0.51) | ALDH1A1HPGDKMT2AMAPTKDM4E |
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-4248869-A | FUNGICIDES | SHIONOGI & CO., LTD. (JP) | 1981-02-03 | — | — | US | claimed |