Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | CXCL12 | P48061 | 2/20 | 0.34 |
| ▸ | BACE1 | P56817 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8039016 | 0.85 | HTT (0.42) | HSP90AA1TRPV1CXCL12BACE1KDM4E | |
| SCHEMBL8035589 | 0.83 | TRPV1 (0.41) | HSP90AA1KMT2ATRPV1CXCL12KDM4E | |
| SCHEMBL8035119 | 0.81 | KDM4E (0.40) | HSP90AA1KMT2ACXCL12BACE1KDM4E | |
| SCHEMBL8035099 | 0.81 | TRPV1 (0.47) | TRPV1 | |
| SCHEMBL8039231 | 0.80 | CTSV (0.43) | KMT2AKDM4EALDH1A1NPC1SMN1; SMN2 | |
| SCHEMBL8023948 | 0.79 | PYGL (0.46) | HSP90AA1KMT2AKDM4ENPC1MAPT | |
| SCHEMBL8039002 | 0.78 | MAPT (0.39) | HSP90AA1KMT2ACXCL12KDM4EALDH1A1 | |
| SCHEMBL8039005 | 0.78 | TRPV1 (0.41) | HSP90AA1TRPV1ALDH1A1 | |
| SCHEMBL8025491 | 0.77 | KDM4E (0.42) | KMT2AKDM4EALDH1A1GFERL3MBTL1 | |
| SCHEMBL8032092 | 0.76 | ALDH1A1 (0.44) | KMT2AKDM4EALDH1A1GFERNPC1 |
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 |