Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL711198 | 0.82 | LMNA (0.52) | CYP2C19LMNAPOLBALDH1A1GAA | |
| SCHEMBL1861854 | 0.81 | LMNA (0.51) | CYP2C19LMNAPOLBALDH1A1GAA | |
| SCHEMBL3662305 | 0.77 | LMNA (0.48) | CYP2C19LMNAALDH1A1HRH1NPC1 | |
| SCHEMBL13002844 | 0.77 | CYP2C19 (0.37) | CYP2C19LMNAPOLBTDP1ALDH1A1 | |
| SCHEMBL5891181 | 0.73 | ALDH1A1 (0.46) | CYP2C19LMNAPOLBALDH1A1GAA | |
| SCHEMBL28754216 | 0.70 | LMNA (0.44) | CYP2C19LMNAPOLBALDH1A1GAA | |
| SCHEMBL3662307 | 0.70 | LMNA (0.43) | CYP2C19LMNAALDH1A1GAA | |
| SCHEMBL13497193 | 0.67 | LMNA (0.43) | CYP2C19LMNAPOLBTDP1 | |
| SCHEMBL9596654 | 0.65 | CA12 (0.46) | ALDH1A1 | |
| SCHEMBL11278773 | 0.65 | POLB (0.61) | LMNAPOLBTDP1HRH1HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002007729-A9 | NON-SEDATING BARBITURATE COMPOUNDS AS NEUROPROTECTIVE AGENTS | TARO PHARMA IND (IL) | 2002-08-08 | — | — | WO | disclosed |