Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPAS1 | Q99814 | 6/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.44 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL16650857 | 0.84 | EPAS1 (0.67) | EPAS1BRD4PTGS1PTGS2 | |
| SCHEMBL20155313 | 0.83 | MEP1B (0.43) | EPAS1ALDH1A1MEP1BSLC22A12BRD4 | |
| SCHEMBL16651328 | 0.81 | EPAS1 (0.71) | EPAS1BRD4PTGS1PTGS2 | |
| SCHEMBL30306252 | 0.81 | EPAS1 (0.71) | EPAS1BRD4PTGS1PTGS2 | |
| SCHEMBL16650802 | 0.80 | EPAS1 (0.72) | EPAS1BRD4PTGS1PTGS2 | |
| SCHEMBL15067831 | 0.78 | EPAS1 (0.66) | EPAS1BRD4PTGS1PTGS2 | |
| SCHEMBL3006563 | 0.78 | ALDH1A1 (0.63) | ALDH1A1KMT2AMEP1BSMN1; SMN2 | |
| SCHEMBL20155326 | 0.78 | ALDH1A1 (0.59) | ALDH1A1KMT2APKMSMN1; SMN2 | |
| SCHEMBL16555815 | 0.76 | EPAS1 (1.00) | EPAS1 | |
| SCHEMBL16333294 | 0.76 | BRD4 (0.57) | EPAS1BRD4 |
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 |