Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.91 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.91 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.75 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.53 |
| ▸ | PIM1 | P11309 | 1/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.53 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.53 |
| ▸ | FLT3 | P36888 | 1/20 | 0.53 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.53 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL10985519 | 0.89 | SMN1; SMN2 (0.83) | HTTSMN1; SMN2ALOX12ALDH1A1NPC1 | |
| SCHEMBL10757398 | 0.87 | HTT (0.70) | HTTSMN1; SMN2ALOX12EPHX1ALDH1A1 | |
| SCHEMBL10852491 | 0.87 | HTT (0.70) | HTTSMN1; SMN2ALOX12EPHX1ALDH1A1 | |
| SCHEMBL8590214 | 0.86 | ALOX12 (1.00) | HTTSMN1; SMN2ALOX12EPHX1ALDH1A1 | |
| SCHEMBL8473735 | 0.85 | HTT (0.67) | HTTSMN1; SMN2ALOX12EPHX1ALDH1A1 | |
| SCHEMBL12410301 | 0.83 | SMN1; SMN2 (0.72) | HTTSMN1; SMN2ALOX12NPC1RAB9A | |
| SCHEMBL13411171 | 0.82 | SMN1; SMN2 (0.71) | HTTSMN1; SMN2ALOX12ALDH1A1NPC1 | |
| SCHEMBL10853481 | 0.82 | SMN1; SMN2 (0.76) | HTTSMN1; SMN2ALOX12NPC1RAB9A | |
| SCHEMBL10756833 | 0.82 | HTT (0.76) | HTTSMN1; SMN2ALOX12EPHX1ALDH1A1 | |
| SCHEMBL2828548 | 0.82 | ALOX12 (0.67) | HTTSMN1; SMN2ALOX12EPHX1ALDH1A1 |
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-1379507-B1 | HETEROARYL UREAS CONTAINING NITROGEN HETERO-ATOMS AS p38 KINASE INHIBITORS | BAYER HEALTHCARE LLC (US) | 2011-08-17 | — | — | EP | disclosed |