Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 6/20 | 0.39 |
| ▸ | BACE1 | P56817 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL8035589 | 0.90 | TRPV1 (0.41) | HTTLMNATRPV1HSP90AA1ALDH1A1 | |
| SCHEMBL8035099 | 0.87 | TRPV1 (0.47) | TRPV1 | |
| SCHEMBL8041247 | 0.85 | HSP90AA1 (0.39) | TRPV1HSP90AA1BACE1ALDH1A1KDM4E | |
| SCHEMBL8035119 | 0.85 | KDM4E (0.40) | LMNAHSP90AA1BACE1ALDH1A1KDM4E | |
| SCHEMBL8039002 | 0.82 | MAPT (0.39) | HTTLMNAHSP90AA1ALDH1A1KDM4E | |
| SCHEMBL8039005 | 0.82 | TRPV1 (0.41) | TRPV1HSP90AA1ALDH1A1 | |
| SCHEMBL8025491 | 0.81 | KDM4E (0.42) | HTTLMNAALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL8032092 | 0.80 | ALDH1A1 (0.44) | HTTLMNAALDH1A1KDM4EGAA | |
| SCHEMBL8035585 | 0.80 | HSP90AA1 (0.41) | LMNATRPV1HSP90AA1ALDH1A1KDM4E | |
| SCHEMBL8035938 | 0.79 | SRD5A1 (0.47) | HTTKDM4ESMN1; SMN2 |
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-2009081892-A1 | NOVEL CATECHOL DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND USE OF THOSE | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 2009-07-02 | — | — | WO | disclosed |