Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | UTS2R | Q9UKP6 | 4/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | TSPO | P30536 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | CFTR | P13569 | 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 | |
|---|---|---|---|---|
| SCHEMBL5036024 | 0.94 | ALDH1A1 (0.37) | KDM4EALDH1A1HTTNPSR1MAPT | |
| SCHEMBL5035235 | 0.91 | CYP3A4 (0.45) | ALDH1A1HTTNPSR1MAPTRAB9A | |
| SCHEMBL5032571 | 0.91 | KDM4E (0.42) | KDM4EALDH1A1HTTNPSR1MAPT | |
| SCHEMBL5032555 | 0.86 | ALDH1A1 (0.44) | KDM4EALDH1A1HTTNPSR1MAPT | |
| SCHEMBL5039136 | 0.85 | CYP3A4 (0.44) | ALDH1A1HTTRAB9ASMN1; SMN2CYP11B1 | |
| SCHEMBL5041385 | 0.85 | CYP3A4 (0.46) | ALDH1A1HTTMAPTRAB9ASMN1; SMN2 | |
| SCHEMBL5032567 | 0.84 | CYP3A4 (0.49) | ALDH1A1NPSR1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL5035010 | 0.83 | CYP3A4 (0.39) | ALDH1A1HTTNPSR1MAPTRAB9A | |
| SCHEMBL5036077 | 0.82 | CYP3A4 (0.42) | KDM4EALDH1A1HTTNPSR1MAPT | |
| SCHEMBL5035132 | 0.81 | KDM4E (0.45) | KDM4EALDH1A1HTTNPSR1MAPT |
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-1694673-B1 | THIAZOLE DERIVATES | HOFFMANN LA ROCHE (CH) | 2008-01-16 | — | — | EP | claimed |