Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 8/20 | 0.48 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.37 |
| ▸ | STK10 | O94804 | 1/20 | 0.36 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.36 |
| ▸ | BRD2 | P25440 | 1/20 | 0.36 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.36 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.36 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.35 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20160282 | 0.80 | BRD4 (0.49) | BRD4BRD2BRD3BRDT | |
| SCHEMBL20159919 | 0.80 | BRD4 (0.47) | BRD4MAPK14ATM | |
| SCHEMBL11307123 | 0.78 | WEE1 (0.51) | ATMSTK10SLKCASP3 | |
| SCHEMBL21904799 | 0.74 | BRD4 (0.50) | BRD4MAPK14TRPA1BRD2BRD3 | |
| SCHEMBL29845843 | 0.71 | BRD4 (0.46) | BRD4MAPK14BRD2BRD3BRDT | |
| SCHEMBL16654848 | 0.71 | BRD4 (0.50) | BRD4MAPK14TRPA1BRD2BRD3 | |
| SCHEMBL16650144 | 0.70 | BRD4 (0.55) | BRD4 | |
| SCHEMBL19930712 | 0.70 | BRD4 (0.68) | BRD4 | |
| SCHEMBL262473 | 0.69 | GSK3B (0.50) | ATMSTK10SLKCASP3 | |
| SCHEMBL21904906 | 0.68 | BRD4 (0.66) | BRD4MAPK14TRPA1BRD2BRD3 |
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-2018086585-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 |