Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 5/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | XBP1 | P17861 | 1/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.44 |
| ▸ | CCR6 | P51684 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 3/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8550890 | 0.83 | ATM (0.55) | MEN1KMT2ANPC1HPGDNPSR1 | |
| SCHEMBL8547799 | 0.77 | KMT2A (0.43) | MEN1KMT2APOLBNPC1HPGD | |
| SCHEMBL28768625 | 0.76 | LRRK2 (0.65) | LRRK2POLBNPC1HPGDNPSR1 | |
| SCHEMBL8551326 | 0.76 | ALDH1A1 (0.44) | MEN1KMT2APOLBNPC1S1PR4 | |
| SCHEMBL16535289 | 0.74 | LRRK2 (0.61) | LRRK2NPC1HPGDNPSR1PIM1 | |
| SCHEMBL16387910 | 0.72 | PDE10A (0.50) | MEN1KMT2APOLBNPC1ALDH1A1 | |
| SCHEMBL4150422 | 0.71 | PDE10A (0.53) | MEN1KMT2APOLBNPC1ALDH1A1 | |
| SCHEMBL30117516 | 0.71 | PDE10A (0.53) | MEN1KMT2APOLBNPC1ALDH1A1 | |
| SCHEMBL29609730 | 0.71 | MAPT (0.44) | LRRK2MEN1KMT2APOLBNPC1 | |
| SCHEMBL3584585 | 0.71 | MAPT (0.44) | LRRK2MEN1KMT2APOLBNPC1 |
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 |