Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.42 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22570215 | 1.00 | RORC (0.48) | RORCTP53LMNAL3MBTL1SLC18A3 | |
| SCHEMBL28079359 | 0.91 | RORC (0.52) | RORCTP53MDM2TACR1 | |
| SCHEMBL28079474 | 0.90 | MEN1 (0.46) | RORCTP53LMNAALDH1A1 | |
| SCHEMBL28079360 | 0.90 | RORC (0.53) | RORCTP53LMNAL3MBTL1ALDH1A1 | |
| SCHEMBL28079469 | 0.88 | TP53 (0.46) | RORCTP53L3MBTL1MDM2TSHR | |
| SCHEMBL28079473 | 0.88 | BCHE (0.45) | LMNAALDH1A1TACR1 | |
| SCHEMBL28079511 | 0.87 | RORC (0.56) | RORCTP53LMNAALDH1A1 | |
| SCHEMBL28079479 | 0.86 | RORC (0.54) | RORCTP53LMNAL3MBTL1TACR1 | |
| SCHEMBL28079472 | 0.86 | POLB (0.44) | RORCTP53LMNA | |
| SCHEMBL28079581 | 0.86 | HRH3 (0.48) | TP53ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105693598-A | Method for synthesis of 3-piperidone derivatives through iridium catalytic hydrogenation | 中国科学院大连化学物理研究所 | 2016-06-22 | — | — | CN | disclosed |