Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.52 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 2/20 | 0.38 |
| ▸ | ELANE | P08246 | 2/20 | 0.37 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | DGKA | P23743 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19018868 | 0.94 | CYP4F2 (0.55) | CYP4F2CYP4A11ALDH1A1ATMELANE | |
| SCHEMBL19255989 | 0.92 | CYP4F2 (0.58) | CYP4F2CYP4A11ATMELANENAAA | |
| SCHEMBL19359962 | 0.92 | CYP4F2 (0.52) | CYP4F2CYP4A11ALDH1A1ATMELANE | |
| Ammonia Solution, Strong SCHEMBL4661755 | 0.90 | CYP4F2 (0.56) | CYP4F2CYP4A11ATMELANENAAA | |
| Hydrochloric Acid SCHEMBL9119593 | 0.89 | CYP4F2 (0.54) | CYP4F2CYP4A11ATMELANENAAA | |
| SCHEMBL27204893 | 0.88 | CYP4F2 (0.53) | CYP4F2CYP4A11ALDH1A1NAAADGKA | |
| SCHEMBL8849916 | 0.87 | CYP4F2 (0.46) | CYP4F2CYP4A11ALDH1A1ELANETSHR | |
| SCHEMBL22540976 | 0.86 | CYP4F2 (0.47) | CYP4F2CYP4A11ALDH1A1ATMELANE | |
| Ammonia Solution, Strong SCHEMBL28636353 | 0.86 | CYP4F2 (0.51) | CYP4F2CYP4A11ALDH1A1NAAADGKA | |
| SCHEMBL18286518 | 0.86 | CYP4F2 (0.47) | CYP4F2CYP4A11ALDH1A1ATMELANE |
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-2521711-B1 | QUATERNARY AMMONIUM SALT PRODRUGS | ALKERMES PHARMA IRELAND LTD (IE) | 2017-08-16 | — | — | EP | disclosed |
| EP-2445502-B1 | HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHOLOGICAL DISORDERS | ALKERMES PHARMA IRELAND LTD (IE) | 2017-06-21 | — | — | EP | disclosed |