Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 2/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16609886 | 0.72 | NOS1 (0.42) | MAPK1NOS1NOS3KMT2A | |
| SCHEMBL16609902 | 0.72 | NOS1 (0.42) | MAPK1NOS1NOS3KMT2A | |
| SCHEMBL761295 | 0.72 | NOS1 (0.42) | MAPK1NOS1NOS3KMT2A | |
| SCHEMBL9962295 | 0.71 | HTR2B (0.40) | MAPK1 | |
| SCHEMBL13722579 | 0.71 | NOS1 (0.36) | SMN1; SMN2LMNAMAPK1ALDH1A1NOS1 | |
| SCHEMBL17168347 | 0.69 | CYP2D6 (0.41) | SMN1; SMN2LMNAMAPK1ALDH1A1KMT2A | |
| SCHEMBL14329369 | 0.68 | HTR2B (0.36) | LMNAMAPK1NOS1NOS3KMT2A | |
| SCHEMBL21371628 | 0.67 | SMN1; SMN2 (0.49) | SMN1; SMN2LMNAALDH1A1KMT2A | |
| SCHEMBL21371627 | 0.67 | SMN1; SMN2 (0.49) | SMN1; SMN2LMNAALDH1A1KMT2A | |
| SCHEMBL761306 | 0.67 | SMN1; SMN2 (0.49) | SMN1; SMN2LMNAALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3753936-A1 | PYRIDONE DERIVATIVE, COMPOSITION THEREOF AND APPLICATION THEREOF AS ANTI-INFLUENZA DRUG | Jiangxi Caishi Pharmaceutical Technology Co., Ltd. (CN) | 2020-12-23 | — | — | EP | disclosed |