Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | MMP13 | P45452 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALPG | P10696 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | ALPI | P09923 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 5/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL8661339 | 0.84 | ALDH1A1 (0.42) | ALDH1A1CYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9048263 | 0.82 | CYP3A4 (0.47) | ALDH1A1CYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9048067 | 0.78 | CA12 (0.44) | ALDH1A1HTTGAALMNAATM | |
| SCHEMBL9050747 | 0.78 | SMN1; SMN2 (0.55) | MMP13SMN1; SMN2GAALMNADAO | |
| SCHEMBL9051430 | 0.78 | HTT (0.47) | ALDH1A1SMN1; SMN2HTTRAB9ADAO | |
| SCHEMBL9047494 | 0.78 | ALDH1A1 (0.39) | ALDH1A1CYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9046628 | 0.77 | CYP1A2 (0.50) | ALDH1A1CYP1A2CYP2C9CYP2C19HTT | |
| SCHEMBL8660050 | 0.76 | ALDH1A1 (0.39) | ALDH1A1CYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL13103908 | 0.76 | ALDH1A1 (0.42) | ALDH1A1CYP2C9MMP13LMNAMMP8 | |
| SCHEMBL8660046 | 0.76 | ALDH1A1 (0.39) | ALDH1A1CYP3A4CYP1A2CYP2D6CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0660826-A4 | 5,5-DISUBSTITUTED HYDANTOINS. | SOUTHERN RES INST (US) | 1996-07-31 | — | — | EP | disclosed |
| EP-0660826-A1 | 5,5-DISUBSTITUTED HYDANTOINS | SOUTHERN RESEARCH INSTITUTE (US) | 1995-07-05 | — | — | EP | disclosed |
| WO-1994006775-A1 | 5,5-DISUBSTITUTED HYDANTOINS | SOUTHERN RESEARCH INSTITUTE (US) | 1994-03-31 | — | — | WO | disclosed |