Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | TTR | P02766 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL28350977 | 0.89 | HCAR2 (0.38) | PDE4DHCAR2DAOALDH1A1HPGD | |
| SCHEMBL12985499 | 0.85 | PDE4D (0.38) | PDE4DHCAR2DAOMEN1LMNA | |
| SCHEMBL22637177 | 0.79 | PDE4D (0.39) | PDE4DHCAR2DAOMEN1LMNA | |
| SCHEMBL20343 | 0.79 | PDE4D (0.61) | PDE4DALDH1A1HPGDMEN1LMNA | |
| SCHEMBL15165958 | 0.76 | — | — | |
| SCHEMBL21393 | 0.76 | HCAR2 (0.37) | HCAR2 | |
| SCHEMBL433234 | 0.71 | KMT2A (0.43) | PDE4DHCAR2DAOMEN1LMNA | |
| SCHEMBL11209524 | 0.71 | HCAR2 (0.44) | PDE4DHCAR2DAOALDH1A1HPGD | |
| SCHEMBL1663754 | 0.70 | PDE4D (0.59) | PDE4DHCAR2DAOMEN1LMNA | |
| SCHEMBL28350940 | 0.68 | PDE4D (0.36) | PDE4DHCAR2DAOALDH1A1HPGD |
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-106467492-B | preparation method of polyfluoromethyl pyrazole compound, intermediate and preparation method | 联化科技(盐城)有限公司 | 2019-12-17 | — | — | CN | disclosed |