Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPAS1 | Q99814 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 4/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.39 |
| ▸ | SCN4A | P35499 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HSPB1 | P04792 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15067206 | 0.86 | KDM4E (0.48) | EPAS1BRD4PKMALDH1A1GAA | |
| SCHEMBL30194335 | 0.82 | EPAS1 (0.51) | EPAS1PKMHSPB1ALDH1A1L3MBTL1 | |
| SCHEMBL16738742 | 0.82 | EPAS1 (0.51) | EPAS1PKMHSPB1ALDH1A1L3MBTL1 | |
| SCHEMBL20155384 | 0.81 | HSPB1 (0.53) | EPAS1BRD4LMNAHTTHSPB1 | |
| SCHEMBL16047284 | 0.81 | EPAS1 (0.50) | EPAS1PKMHSPB1ALDH1A1L3MBTL1 | |
| SCHEMBL16047925 | 0.81 | EPAS1 (0.50) | EPAS1PKMHSPB1ALDH1A1L3MBTL1 | |
| SCHEMBL2443815 | 0.79 | EPAS1 (0.48) | EPAS1BRD4HSPB1ALDH1A1 | |
| SCHEMBL4855967 | 0.78 | HSPB1 (0.50) | BRD4SCN4AHSPB1ALDH1A1KEAP1 | |
| SCHEMBL15067364 | 0.77 | BRD4 (0.58) | EPAS1BRD4ALDH1A1HPGD | |
| SCHEMBL16048593 | 0.76 | EPAS1 (0.48) | EPAS1HSPB1ALDH1A1 |
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 |