Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | KHK | P50053 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | MELK | Q14680 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15545286 | 0.83 | ALDH1A1 (0.52) | SIGMAR1MEN1KMT2AALDH1A1ALOX15 | |
| SCHEMBL3861754 | 0.81 | SMN1; SMN2 (0.49) | CA1CA2CA9SIGMAR1MEN1 | |
| SCHEMBL529294 | 0.81 | SIGMAR1 (0.47) | HTR4CA1CA2CA9SIGMAR1 | |
| SCHEMBL5752131 | 0.74 | SIGMAR1 (0.53) | CA1CA2CA9SIGMAR1KHK | |
| SCHEMBL7672095 | 0.72 | SIGMAR1 (0.53) | CA1CA2CA9SIGMAR1KHK | |
| SCHEMBL9892421 | 0.72 | KHK (0.40) | HTR4CA1CA2CA9SIGMAR1 | |
| SCHEMBL18570638 | 0.72 | GAA (0.45) | ALDH1A1ALOX15TSHRCYP3A4GAA | |
| SCHEMBL9111538 | 0.71 | KMT2A (0.44) | CA1CA2CA9SIGMAR1KHK | |
| SCHEMBL16477260 | 0.71 | LMNA (0.42) | CA1CA2CA9MEN1KMT2A | |
| SCHEMBL7855130 | 0.70 | ABL1 (0.51) | ALDH1A1ALOX15TSHRCYP1A2CCNT1 |
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-2436670-B1 | Preparation of 1-(substituted aryl)-5-trifluoromethyl-2-(1H)pyridone compounds and salts thereof and their applications | UNIV CENTRAL SOUTH (CN) | 2014-04-16 | — | — | EP | disclosed |