Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SLC6A6 | P31641 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | KCNA1 | Q09470 | 1/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9165215 | 0.85 | DNM1 (0.42) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| SCHEMBL34652 | 0.83 | DNM1 (0.46) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| Water SCHEMBL918201 | 0.83 | DNM1 (0.41) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| SCHEMBL34923 | 0.81 | DNM1 (0.39) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| Sulfuric Acid SCHEMBL20573201 | 0.80 | BBOX1 (0.44) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| SCHEMBL34817 | 0.80 | DNM1 (0.43) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| Tetrylammonium SCHEMBL330820 | 0.79 | TSHR (0.42) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| SCHEMBL34922 | 0.78 | BBOX1 (0.42) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| Sulfuric Acid SCHEMBL20573200 | 0.78 | BBOX1 (0.42) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| Tetrylammonium SCHEMBL331298 | 0.77 | TSHR (0.53) | PTGS1PDE4ALMNASLC6A6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104955903-A | Functional materials with reversible crosslinking | EVONIK INDUSTRIES AG | 2015-09-30 | — | — | CN | disclosed |