Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.45 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.40 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | RAF1 | P04049 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.40 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.38 |
| ▸ | RAD52 | P43351 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 2/20 | 0.37 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30313179 | 0.88 | ALDH1A1 (0.45) | AAK1HDAC1HDAC2WDR5HDAC3 | |
| SCHEMBL15243333 | 0.87 | ALDH1A1 (0.44) | AAK1AURKBEGFRHDAC1WDR5 | |
| SCHEMBL23731848 | 0.87 | AAK1 (0.59) | AAK1AURKBEGFRRAF1KDR | |
| SCHEMBL38663449 | 0.86 | HDAC1 (0.48) | AAK1HDAC1HDAC2HDAC3HDAC10 | |
| SCHEMBL2227781 | 0.84 | AAK1 (0.48) | AAK1HDAC1HDAC2HDAC3GAA | |
| SCHEMBL28124107 | 0.82 | EGFR (0.42) | AAK1AURKBEGFRRAF1KDR | |
| SCHEMBL38663435 | 0.81 | AAK1 (0.48) | AAK1WDR5 | |
| SCHEMBL22012941 | 0.80 | AAK1 (0.64) | AAK1AURKBEGFRRAF1KDR | |
| SCHEMBL38661718 | 0.80 | AAK1 (0.47) | AAK1AURKBEGFRHDAC1WDR5 | |
| SCHEMBL17132206 | 0.80 | AAK1 (0.47) | AAK1AURKBEGFRHDAC1WDR5 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011115080-A1 | POLYAMIC ACID ESTER LIQUID CRYSTAL ALIGNMENT AGENT, AND LIQUID CRYSTAL ALIGNMENT FILM USING SAME | 日産化学工業株式会社 (JP) | 2011-09-22 | — | — | WO | disclosed |
| US-6265588-B1 | USE AS PHARMACEUTICALS; AS AN ANTIGEN FOR PRODUCTION OF ANTIBODIES AND IN DIAGNOSIS AND PURIFICATION | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2001-07-24 | — | — | US | disclosed |
| US-6121479-A | ANTIINFLAMMATORY AND ANTICARCINOGENIC AGENTS; AUTOIMMUNE DISEASES | HOECHST AKTIENGESELLSCHAFT (DE) | 2000-09-19 | — | — | US | disclosed |
| US-5977151-A | ANTITUMOR | HOECHST AKTIENGESELLSCHAFT (DE) | 1999-11-02 | — | — | US | disclosed |