Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | GABRP | O00591 | 1/20 | 0.40 |
| ▸ | GABRD | O14764 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.40 |
| ▸ | GABRE | P78334 | 1/20 | 0.40 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.40 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.40 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.40 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13409358 | 0.80 | MAPT (0.47) | ALDH1A1KDM4EPLAUGABRPGABRD | |
| SCHEMBL13409373 | 0.79 | CYP1A2 (0.45) | ALDH1A1KDM4ECYP1A2MAPTATM | |
| SCHEMBL13409304 | 0.79 | TRPM8 (0.51) | ALDH1A1KDM4EGABRPGABRDGABRA1 | |
| SCHEMBL8271643 | 0.79 | ALDH1A1 (0.56) | ALDH1A1KDM4EPLAUGABRPGABRD | |
| SCHEMBL26375268 | 0.74 | PLAU (0.41) | ALDH1A1PLAUCYP1A2CYP2C19CYP2A6 | |
| SCHEMBL7392183 | 0.73 | PLAU (0.40) | ALDH1A1KDM4EPLAUCYP1A2MAPT | |
| SCHEMBL13154921 | 0.72 | PLAU (0.46) | ALDH1A1KDM4EPLAUGABRA1GABRB2 | |
| SCHEMBL291193 | 0.70 | CYP2A6 (0.50) | ALDH1A1KDM4EPLAUCYP1A2MAPT | |
| SCHEMBL7810629 | 0.70 | KDM4E (0.53) | ALDH1A1KDM4ECYP1A2MAPTATM | |
| SCHEMBL13409364 | 0.69 | ALDH1A1 (0.72) | ALDH1A1KDM4EGABRA1GABRG2GABRB3 |
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-7705146-B2 | Hepatitis C inhibitor peptide analogs | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-04-27 | — | — | US | disclosed |