Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
| ▸ | BRD2 | P25440 | 1/20 | 0.30 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20155081 | 0.82 | NR4A2 (0.31) | — | |
| SCHEMBL17873844 | 0.77 | ADORA2A (0.40) | LMNACYP3A4MAPTAPEX1MAPK1 | |
| SCHEMBL20155079 | 0.74 | POLB (0.38) | LMNACYP3A4MAPTAPEX1MAPK1 | |
| SCHEMBL20155042 | 0.73 | MAP4K4 (0.42) | DYRK1A | |
| SCHEMBL20155612 | 0.73 | LMNA (0.34) | F2RL3LMNACYP3A4MAPTAPEX1 | |
| SCHEMBL24035856 | 0.72 | ACACB (0.34) | F2RL3LMNACYP3A4MAPTAPEX1 | |
| SCHEMBL20155347 | 0.72 | MAT2A (0.38) | LMNACYP3A4MAPTAPEX1MAPK1 | |
| SCHEMBL22216456 | 0.70 | ALDH1A1 (0.44) | LMNAMAPT | |
| SCHEMBL23531689 | 0.68 | PDE4D (0.43) | LMNA | |
| SCHEMBL20155400 | 0.68 | PDE4D (0.39) | LMNACYP3A4MAPTAPEX1MAPK1 |
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 |