Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 3/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | CYP2A13 | Q16696 | 2/20 | 0.31 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.30 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.30 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6942412 | 0.79 | SLC6A4 (0.37) | PDK2PDK1PDK3PDK4 | |
| SCHEMBL6940427 | 0.68 | SLC6A3 (0.37) | — | |
| SCHEMBL10875357 | 0.59 | GRIN1 (0.44) | — | |
| SCHEMBL11453212 | 0.59 | CYP2A13 (0.35) | P2RX7CYP2A13 | |
| SCHEMBL10877467 | 0.57 | TAAR1 (0.41) | — | |
| Fluoromethane SCHEMBL28306611 | 0.56 | TSHR (0.52) | — | |
| SCHEMBL25156642 | 0.56 | KDM1A (0.41) | PDK2 | |
| SCHEMBL30344161 | 0.56 | KDM1A (0.41) | PDK2 | |
| SCHEMBL8207739 | 0.56 | TSHR (0.38) | PDK2 | |
| SCHEMBL3613800 | 0.55 | TAAR1 (0.78) | — |
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-0927719-A1 | Triazole derivative or salt thereof, preparation process thereof as well as pharmaceutical containing said compound | SSP Co., Ltd. (JP) | 1999-07-07 | — | — | EP | disclosed |