Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM2 | P50570 | 7/20 | 0.65 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.63 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ALPG | P10696 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | KIT | P10721 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12497656 | 0.81 | DNM2 (0.62) | DNM2HRH4HRH3CYP2C19MAP4K4 | |
| SCHEMBL17581278 | 0.79 | DNM2 (0.60) | DNM2HRH4HRH3CYP2C19MAP4K4 | |
| SCHEMBL1774003 | 0.78 | HRH4 (1.00) | DNM2HRH4HRH3CYP2C19MAP4K4 | |
| SCHEMBL17300725 | 0.77 | DNM2 (0.57) | DNM2HRH4HRH3CYP2C19MAP4K4 | |
| SCHEMBL12410840 | 0.77 | DNM2 (0.57) | DNM2HRH4HRH3CYP2C19MAP4K4 | |
| SCHEMBL13472373 | 0.74 | DNM2 (0.55) | DNM2HRH4HRH3CYP2C19MAP4K4 | |
| SCHEMBL4076540 | 0.74 | L3MBTL1 (0.42) | GAAEGFRCHEK1 | |
| SCHEMBL27523685 | 0.72 | EGFR (0.51) | DNM2HRH4CYP2C19MAP4K4EGFR | |
| SCHEMBL2948693 | 0.72 | HRH4 (0.55) | DNM2HRH4HRH3CYP2C19MAP4K4 | |
| SCHEMBL15834613 | 0.71 | DNM2 (0.59) | DNM2HRH4EGFRLCK |
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-1562589-B1 | DIAMINOTRIAZOLES USEFUL AS INHIBITORS OF PROTEIN KINASES | VERTEX PHARMA (US) | 2009-01-07 | — | — | EP | disclosed |