Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPB1 | P04792 | 6/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL15067230 | 0.89 | HSPB1 (0.54) | HSPB1TDP1L3MBTL1MAPTGAA | |
| SCHEMBL15770914 | 0.86 | HSPB1 (0.51) | HSPB1TDP1L3MBTL1MAPTGAA | |
| SCHEMBL16049146 | 0.83 | HSPB1 (0.62) | HSPB1TDP1L3MBTL1MAPTGAA | |
| SCHEMBL16046439 | 0.83 | HSPB1 (0.66) | HSPB1TDP1L3MBTL1MAPTGAA | |
| SCHEMBL16738733 | 0.83 | HSPB1 (0.58) | HSPB1TDP1L3MBTL1MAPTGAA | |
| SCHEMBL15067957 | 0.82 | HSPB1 (0.47) | HSPB1TDP1L3MBTL1MAPTGAA | |
| SCHEMBL20154948 | 0.81 | EPAS1 (0.46) | HSPB1L3MBTL1GAAHTTEPAS1 | |
| SCHEMBL28657257 | 0.81 | HSPB1 (0.59) | HSPB1TDP1L3MBTL1MAPTGAA | |
| SCHEMBL4857147 | 0.81 | HSPB1 (0.58) | HSPB1TDP1L3MBTL1MAPTGAA | |
| SCHEMBL29549341 | 0.80 | HSPB1 (0.58) | HSPB1TDP1L3MBTL1MAPTGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018086604-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |