Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMO | O15229 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PRF1 | P14222 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | UCHL3 | P15374 | 1/20 | 0.34 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8981302 | 0.92 | ALDH1A1 (0.41) | ALDH1A1USP2HTTKMOKDM4E | |
| SCHEMBL9171003 | 0.86 | MEN1 (0.41) | ALDH1A1HTTKDM4EMAPTPRF1 | |
| SCHEMBL8638816 | 0.84 | ALDH1A1 (0.41) | ALDH1A1MAPTHPGD | |
| SCHEMBL9302635 | 0.82 | MAOB (0.36) | ALDH1A1USP2HTTMAOBMAPT | |
| SCHEMBL8573189 | 0.82 | MAOB (0.40) | ALDH1A1USP2HTTKMOMAOB | |
| SCHEMBL8981007 | 0.81 | ALDH1A1 (0.42) | ALDH1A1HTTMAPTPRF1CYP3A4 | |
| SCHEMBL9164262 | 0.80 | MAOB (0.44) | ALDH1A1HTTKMOMAOBMAPT | |
| SCHEMBL9173014 | 0.80 | MAOB (0.35) | KMOMAOBMAPT | |
| SCHEMBL9493171 | 0.77 | ALDH1A1 (0.36) | ALDH1A1HTTHPGD | |
| SCHEMBL8980698 | 0.77 | PRMT5 (0.41) | ALDH1A1USP2KDM4EMAPTPRF1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0490183-B1 | Benzoxazinone and benzothiazinone derivatives endowed with cardiovascular activity | ITALFARMACO SPA (IT) | 1995-04-19 | — | — | EP | disclosed |