Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.40 |
| ▸ | STK4 | Q13043 | 1/20 | 0.40 |
| ▸ | STK3 | Q13188 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | METAP2 | P50579 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.37 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11538510 | 0.99 | LRRK2 (0.39) | LRRK2STK4STK3IDO1METAP2 | |
| SCHEMBL11537638 | 0.82 | LRRK2 (0.40) | LRRK2STK4STK3IDO1NOTUM | |
| SCHEMBL11539457 | 0.81 | ALDH1A1 (0.34) | LRRK2STK4STK3HPGDALDH1A1 | |
| SCHEMBL11743569 | 0.74 | LRRK2 (0.49) | LRRK2STK4STK3IDO1METAP2 | |
| SCHEMBL11541771 | 0.72 | ADH5 (0.36) | METAP2NOTUMNPC1KMT2AGAA | |
| SCHEMBL11537253 | 0.72 | DYRK1A (0.35) | LRRK2STK4STK3 | |
| SCHEMBL6850959 | 0.66 | IDO1 (0.46) | IDO1METAP2HPGDPPARGNCOA2 | |
| SCHEMBL5256574 | 0.66 | MAPK14 (0.49) | LRRK2 | |
| SCHEMBL10053917 | 0.64 | HSP90AA1 (0.47) | HPGDRAB9ANPC1ALDH1A1MAPT | |
| SCHEMBL8884373 | 0.64 | IDO1 (0.44) | IDO1METAP2HPGDPPARGNCOA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4169838-A | PYRAZOLYLTRIAZOLE HERBICIDES | AMERICAN CYANAMID COMPANY (US) | 1979-10-02 | — | — | US | disclosed |
| US-4115097-A | Pyrazolyltriazole herbicides | AMERICAN CYANAMID COMPANY (US) | 1978-09-19 | — | — | US | disclosed |