Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | RXRA | P19793 | 1/20 | 0.37 |
| ▸ | RXRB | P28702 | 1/20 | 0.37 |
| ▸ | RXRG | P48443 | 1/20 | 0.37 |
| ▸ | THRA | P10827 | 5/20 | 0.36 |
| ▸ | THRB | P10828 | 5/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.36 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14192565 | 0.91 | CYP2C9 (0.40) | CYP2C9MRGPRX4ALDH1A1MAPTLMNA | |
| SCHEMBL14192580 | 0.88 | CYP2C9 (0.40) | CYP2C9ALDH1A1MAPTLMNANPC1 | |
| SCHEMBL14192554 | 0.86 | CYP2C9 (0.41) | CYP2C9MRGPRX4ALDH1A1MAPTLMNA | |
| SCHEMBL14219188 | 0.81 | CYP2C9 (0.40) | CYP2C9ALDH1A1MAPTLMNANPC1 | |
| SCHEMBL14192531 | 0.78 | THRB (0.37) | MAPTNPC1RAB9ATHRATHRB | |
| SCHEMBL14192450 | 0.76 | RAB9A (0.47) | CYP2C9ALDH1A1MAPTLMNARAB9A | |
| SCHEMBL14192552 | 0.75 | CYP2C9 (0.43) | CYP2C9ALDH1A1MAPTLMNARAB9A | |
| SCHEMBL14192446 | 0.75 | TP53 (0.47) | CYP2C9ALDH1A1MAPTLMNARAB9A | |
| SCHEMBL14192406 | 0.75 | TP53 (0.47) | CYP2C9ALDH1A1MAPTLMNARAB9A | |
| SCHEMBL14192322 | 0.75 | CYP2C9 (0.56) | CYP2C9ALDH1A1MAPTLMNATHRA |
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 |
|---|---|---|---|---|---|---|---|
| US-7357964-B2 | Liquid-crystalline vinyl ketone derivatives and their polymers | CHISSO CORPORATION (JP) | 2008-04-15 | — | — | US | disclosed |