Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLAU | P00749 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | PLG | P00747 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | F12 | P00748 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.36 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | CCR6 | P51684 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 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 SCHEMBL8550917 | 0.83 | PLAU (0.45) | PLAUNPC1RAB9APLGMAPK1 | |
| SCHEMBL8551326 | 0.79 | ALDH1A1 (0.44) | NPC1RAB9APOLBNCOA1NCOA3 | |
| SCHEMBL8552284 | 0.79 | PLAU (0.40) | PLAUNPC1RAB9APOLBPLG | |
| SCHEMBL8553138 | 0.78 | POLB (0.37) | NPC1RAB9APOLBMAPK1F12 | |
| SCHEMBL8552965 | 0.71 | PLAU (0.44) | PLAUPLGADORA3HSP90AA1NPSR1 | |
| SCHEMBL8548686 | 0.71 | LRRK2 (0.49) | NPC1RAB9APOLBMAPK1NCOA1 | |
| SCHEMBL16387910 | 0.68 | PDE10A (0.50) | NPC1RAB9APOLBF12NCOA1 | |
| SCHEMBL4150422 | 0.67 | PDE10A (0.53) | NPC1RAB9APOLBMAPK1F12 | |
| SCHEMBL30117516 | 0.67 | PDE10A (0.53) | NPC1RAB9APOLBMAPK1F12 | |
| SCHEMBL11224715 | 0.66 | F12 (0.52) | NPC1RAB9AMAPK1F12MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0825187-A1 | Condensed pyridazinyl guanidines, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-02-25 | — | — | EP | disclosed |