Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | RAF1 | P04049 | 1/20 | 0.34 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL5228396 | 0.92 | KMT2A (0.34) | SMN1; SMN2ALDH1A1KDM4EOPRM1MEN1 | |
| SCHEMBL5229383 | 0.89 | SMN1; SMN2 (0.36) | SMN1; SMN2ALDH1A1KDM4EIDH1HRH3 | |
| SCHEMBL5233481 | 0.87 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL5236136 | 0.86 | — | — | |
| SCHEMBL5233446 | 0.85 | NPC1 (0.35) | ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL5236387 | 0.85 | KDM4E (0.39) | SMN1; SMN2ALDH1A1KDM4EHRH3MEN1 | |
| SCHEMBL5232666 | 0.85 | — | — | |
| SCHEMBL5232338 | 0.85 | S1PR1 (0.34) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL5235412 | 0.85 | NAMPT (0.31) | — | |
| SCHEMBL5238208 | 0.84 | ALDH1A1 (0.38) | SMN1; SMN2ALDH1A1KDM4EHRH3MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1730116-B1 | 4-CARBOX PYRAZOLE DERIVATES USEFUL AS ANTI-VIRAL AGENTS | SMITHKLINE BEECHAM CORP (US) | 2007-09-05 | — | — | EP | claimed |