Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.31 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | GPR174 | Q9BXC1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10929444 | 1.00 | CYP2C9 (0.43) | CYP2C9ALDH1A1MAPTLMNAMAPK1 | |
| SCHEMBL5886540 | 0.99 | CYP2C9 (0.42) | CYP2C9ALDH1A1MAPTLMNAMAPK1 | |
| SCHEMBL5886535 | 0.99 | CYP2C9 (0.42) | CYP2C9ALDH1A1MAPTLMNAMAPK1 | |
| SCHEMBL10930880 | 0.96 | CYP2C9 (0.40) | CYP2C9ALDH1A1MAPTLMNAMAPK1 | |
| SCHEMBL10895750 | 0.96 | CYP2C9 (0.40) | CYP2C9ALDH1A1MAPTLMNAMAPK1 | |
| SCHEMBL10895765 | 0.96 | CYP2C9 (0.40) | CYP2C9ALDH1A1MAPTLMNAMAPK1 | |
| SCHEMBL10894589 | 0.92 | CYP2C9 (0.35) | CYP2C9ALDH1A1MAPTLMNAMAPK1 | |
| SCHEMBL10894584 | 0.92 | CYP2C9 (0.35) | CYP2C9ALDH1A1MAPTLMNAMAPK1 | |
| SCHEMBL10892210 | 0.91 | MEN1 (0.37) | CYP2C9ALDH1A1MAPTLMNAMAPK1 | |
| SCHEMBL10892201 | 0.91 | MEN1 (0.37) | CYP2C9ALDH1A1MAPTLMNAMAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4551264-A | Polyhalogenoaromatic compounds for liquid crystal compositions | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1985-11-05 | — | — | US | disclosed |
| EP-0090183-A1 | Polyhalogenated aromatic compounds | MERCK PATENT GmbH (DE) | 1983-10-05 | — | — | EP | disclosed |