Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | HTT | P42858 | 3/20 | 0.33 |
| ▸ | ALPL | P05186 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9784641 | 0.81 | S1PR1 (0.41) | AOC3SLC6A2SLC6A4SLC6A3KDM4E | |
| Hydrochloric Acid SCHEMBL9784650 | 0.80 | KDM4E (0.39) | AOC3SLC6A2SLC6A4SLC6A3KDM4E | |
| SCHEMBL22978614 | 0.80 | HTT (0.36) | AOC3KDM4EHTTTDP1ALDH1A1 | |
| SCHEMBL22978602 | 0.80 | EGFR (0.37) | KDM4EALDH1A1MAPK1HSD17B10CYP3A4 | |
| SCHEMBL13765676 | 0.75 | GABRP (0.40) | AOC3SLC6A2SLC6A4SLC6A3KDM4E | |
| SCHEMBL9784701 | 0.74 | TSHR (0.39) | KDM4EHTTALDH1A1MAPK1HSD17B10 | |
| SCHEMBL25004559 | 0.73 | HPGD (0.39) | AOC3SLC6A2SLC6A4SLC6A3KDM4E | |
| SCHEMBL19466204 | 0.73 | ESR1 (0.38) | AOC3SLC6A2SLC6A4SLC6A3KDM4E | |
| SCHEMBL13324326 | 0.70 | KDM4E (0.49) | KDM4EHTTALPLTDP1ALDH1A1 | |
| SCHEMBL13952464 | 0.69 | PTGS2 (0.36) | HTTALDH1A1MEN1KMT2ATSHR |
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-2021026672-A1 | HETEROCYCLIC WDR5 INHIBITORS AS ANTI-CANCER COMPOUNDS | NOVARTIS AG (CH) | 2021-02-18 | — | — | WO | disclosed |