Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.61 |
| ▸ | ATM | Q13315 | 1/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.59 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1223722 | 1.00 | HDAC4 (0.61) | HDAC4ATMSLC6A4SLC6A3SLC6A2 | |
| SCHEMBL1223719 | 1.00 | HDAC4 (0.61) | HDAC4ATMSLC6A4SLC6A3SLC6A2 | |
| SCHEMBL29451691 | 1.00 | HDAC4 (0.61) | HDAC4ATMSLC6A4SLC6A3SLC6A2 | |
| SCHEMBL6468821 | 0.90 | ATM (0.55) | HDAC4ATMSLC6A4SLC6A3SLC6A2 | |
| SCHEMBL7226867 | 0.90 | ATM (0.55) | HDAC4ATMSLC6A4SLC6A3SLC6A2 | |
| SCHEMBL6467986 | 0.89 | ATM (0.54) | HDAC4ATMSLC6A4SLC6A3SLC6A2 | |
| SCHEMBL17712999 | 0.87 | SLC6A3 (0.66) | ATMSLC6A4SLC6A3SLC6A2 | |
| SCHEMBL2773904 | 0.87 | KDM1A (0.53) | HDAC4ATMSLC6A4SLC6A3SLC6A2 | |
| SCHEMBL2773905 | 0.87 | KDM1A (0.53) | HDAC4ATMSLC6A4SLC6A3SLC6A2 | |
| SCHEMBL9753434 | 0.85 | SLC6A3 (0.56) | ATMSLC6A4SLC6A3SLC6A2 |
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-2376408-A2 | FLUORINATION OF ORGANIC COMPOUNDS | President and Fellows of Harvard College (US) | 2011-10-19 | — | — | EP | disclosed |
| WO-2010059943-A2 | FLUORINATION OF ORGANIC COMPOUNDS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2010-05-27 | — | — | WO | disclosed |