Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 3/20 | 0.39 |
| ▸ | CES1 | P23141 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | EBP | Q15125 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19326612 | 0.86 | LMNA (0.35) | HSP90AA1CES2CES1ALDH1A1GAA | |
| SCHEMBL8579302 | 0.80 | HSP90AA1 (0.43) | HSP90AA1CES2CES1ALDH1A1GAA | |
| SCHEMBL3191399 | 0.80 | HSP90AA1 (0.43) | HSP90AA1CES2CES1ALDH1A1GAA | |
| SCHEMBL896258 | 0.80 | HSP90AA1 (0.43) | HSP90AA1CES2CES1ALDH1A1GAA | |
| SCHEMBL8580645 | 0.80 | HSP90AA1 (0.43) | HSP90AA1CES2CES1ALDH1A1GAA | |
| SCHEMBL15808773 | 0.79 | KIF11 (0.53) | KIF11 | |
| SCHEMBL1854553 | 0.78 | HSP90AA1 (0.39) | HSP90AA1CES2CES1ALDH1A1NAAA | |
| SCHEMBL3847845 | 0.78 | HSP90AA1 (0.45) | HSP90AA1CES2CES1ALDH1A1GAA | |
| SCHEMBL3663774 | 0.78 | HSP90AA1 (0.45) | HSP90AA1CES2CES1ALDH1A1GAA | |
| SCHEMBL3660417 | 0.78 | HSP90AA1 (0.45) | HSP90AA1CES2CES1ALDH1A1GAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0058335-B1 | DIAMINES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS CHAIN EXTENDERS IN THE PRODUCTION OF POLYURETHANE PLASTICS | BAYER AG (DE) | 1985-06-26 | — | — | EP | disclosed |
| EP-0058335-A2 | Diamines, process for their preparation, and their use as chain extenders in the production of polyurethane plastics | BAYER AG (DE) | 1982-08-25 | — | — | EP | disclosed |