Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | THRA | P10827 | 5/20 | 0.33 |
| ▸ | THRB | P10828 | 5/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.33 |
| ▸ | ACR | P10323 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
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 | 0.89 | CYP2C9 (0.40) | CYP2C9MAPTLMNAALDH1A1MCHR1 | |
| SCHEMBL14192552 | 0.88 | CYP2C9 (0.43) | CYP2C9MAPTLMNAALDH1A1KMT2A | |
| SCHEMBL14192570 | 0.88 | CYP2C9 (0.39) | CYP2C9MAPTLMNAALDH1A1KMT2A | |
| SCHEMBL14219188 | 0.83 | CYP2C9 (0.40) | CYP2C9MAPTLMNAALDH1A1MCHR1 | |
| SCHEMBL14192531 | 0.83 | THRB (0.37) | MAPTKMT2AMEN1THRATHRB | |
| SCHEMBL14192430 | 0.81 | CYP2C9 (0.55) | CYP2C9MAPTLMNAALDH1A1KMT2A | |
| SCHEMBL14192445 | 0.81 | CYP2C9 (0.55) | CYP2C9MAPTLMNAALDH1A1KMT2A | |
| SCHEMBL14192572 | 0.79 | CYP2C9 (0.40) | CYP2C9MAPTLMNAALDH1A1KMT2A | |
| SCHEMBL14192558 | 0.79 | KMT2A (0.44) | MAPTLMNAALDH1A1MCHR1KMT2A | |
| SCHEMBL14192510 | 0.78 | CYP2C9 (0.52) | CYP2C9MAPTLMNAALDH1A1MCHR1 |
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 |