Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.42 |
| ▸ | IDH1 | O75874 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24307297 | 0.84 | HRH3 (0.45) | HRH3ALDH1A1 | |
| SCHEMBL19178207 | 0.83 | PARP1 (0.44) | HRH3LTA4HIDH1ALDH1A1 | |
| SCHEMBL14846571 | 0.83 | PARP1 (0.44) | HRH3LTA4HIDH1ALDH1A1 | |
| SCHEMBL1935806 | 0.83 | HRH3 (0.67) | HRH3ALDH1A1SMN1; SMN2 | |
| SCHEMBL14847024 | 0.83 | HRH3 (0.67) | HRH3ALDH1A1SMN1; SMN2 | |
| Isopropylamine SCHEMBL7081467 | 0.82 | ACHE (0.62) | LTA4HACHEALDH1A1 | |
| SCHEMBL19192550 | 0.81 | TRPV6 (0.48) | HRH3IDH1ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL14847029 | 0.81 | TRPV6 (0.48) | HRH3IDH1ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL19778598 | 0.80 | LMNA (0.64) | HRH3ALDH1A1 | |
| SCHEMBL21378560 | 0.80 | LMNA (0.64) | HRH3ALDH1A1 |
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-2013046136-A1 | 3-PYRIMIDIN-4-YL-OXAZOLIDIN-2-ONES AS INHIBITORS OF MUTANT IDH | NOVARTIS AG (CH) | 2013-04-04 | — | — | WO | disclosed |