Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TLR4 | O00206 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2885386 | 1.00 | CYP2C9 (0.42) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL12976254 | 1.00 | CYP2C9 (0.42) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8735093 | 0.92 | CYP2C9 (0.42) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8735099 | 0.92 | CYP2C9 (0.42) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8735096 | 0.92 | CYP2C9 (0.42) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL7569241 | 0.84 | CYP2C9 (0.43) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8737129 | 0.84 | CYP2C9 (0.43) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL3437358 | 0.84 | CYP2C9 (0.43) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL2884363 | 0.84 | CYP2C9 (0.43) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL12976822 | 0.83 | CYP2C9 (0.36) | CYP2C9ALDH1A1MAPTLMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0449015-B1 | Difluoromethyl compounds and liquid criystal medium | MERCK PATENT GMBH (DE) | 1998-07-01 | — | — | EP | disclosed |
| EP-0449015-A2 | Difluoromethyl compounds and liquid criystal medium | MERCK PATENT GmbH (DE) | 1991-10-02 | — | — | EP | disclosed |