Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | POLQ | O75417 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6311459 | 0.80 | ESR1 (0.39) | ESR1ALDH1A1MEN1KMT2AMAPT | |
| Water SCHEMBL28929336 | 0.78 | ESR1 (0.38) | ESR1ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL9821084 | 0.77 | ALDH1A1 (0.44) | ESR1HDAC6ALDH1A1RAB9AKDM4E | |
| SCHEMBL21286204 | 0.76 | CNR2 (0.34) | ESR1ALDH1A1MEN1KMT2AACHE | |
| SCHEMBL242391 | 0.75 | KMT2A (0.46) | ALDH1A1RAB9AMEN1NPC1KMT2A | |
| SCHEMBL5503259 | 0.75 | NR1H2 (0.42) | ALDH1A1MEN1KMT2ARORCMAPT | |
| SCHEMBL8217171 | 0.74 | ALDH1A1 (0.35) | ESR1ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL5523437 | 0.74 | KMT2A (0.45) | ALDH1A1RAB9AMEN1NPC1KMT2A | |
| SCHEMBL30848429 | 0.74 | KMT2A (0.45) | ESR1ALDH1A1RAB9AMEN1NPC1 | |
| SCHEMBL21288007 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1828111-A2 | METHODS AND FLUORINATED COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES | Neurochem (International) Limited (CH) | 2007-09-05 | — | — | EP | disclosed |
| WO-2006059252-A2 | METHODS AND FLUORINATED COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES | NEUROCHEM (INTERNATIONAL) LIMITED (CH) | 2006-06-08 | — | — | WO | disclosed |