Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 3/20 | 0.32 |
| ▸ | FEN1 | P39748 | 3/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | METAP2 | P50579 | 1/20 | 0.30 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.30 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.30 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.30 |
| ▸ | MME | P08473 | 1/20 | 0.30 |
| ▸ | GNRHR | P30968 | 1/20 | 0.30 |
| ▸ | PRKCI | P41743 | 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 | |
|---|---|---|---|---|
| SCHEMBL20889598 | 0.77 | ALDH1A1 (0.36) | ALDH1A1KDM4EALOX5APFEN1BRD4 | |
| SCHEMBL4235012 | 0.77 | KDM4E (0.36) | ALDH1A1KDM4EALOX5APFEN1BRD4 | |
| SCHEMBL7214964 | 0.77 | ALDH1A1 (0.40) | ALDH1A1KDM4EALOX5APFEN1BRD4 | |
| SCHEMBL27430993 | 0.74 | POLA1 (0.39) | ALDH1A1KDM4EALOX5APFEN1BRD4 | |
| SCHEMBL10719652 | 0.73 | AURKA (0.41) | ALDH1A1KDM4EPARP1METAP2PIK3CA | |
| SCHEMBL23420495 | 0.72 | MME (0.34) | ALDH1A1KDM4EALOX5APFEN1BRD4 | |
| SCHEMBL18393529 | 0.70 | POLA1 (0.45) | — | |
| SCHEMBL2190488 | 0.70 | ALDH1A1 (0.48) | ALDH1A1KDM4EALOX5APFEN1BRD4 | |
| SCHEMBL21906548 | 0.70 | ALDH1A1 (0.39) | ALDH1A1KDM4EALOX5APFEN1BRD4 | |
| SCHEMBL30770845 | 0.70 | ALDH1A1 (0.48) | ALDH1A1KDM4EALOX5APFEN1BRD4 |
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-3999505-A1 | PESTICIDAL PYRAZOLE AND TRIAZOLE DERIVATIVES | BASF SE (DE) | 2022-05-25 | — | — | EP | disclosed |