Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | RAD52 | P43351 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TSPO | P30536 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | GHSR | Q92847 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 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 | |
|---|---|---|---|---|
| SCHEMBL5032555 | 0.93 | ALDH1A1 (0.44) | KDM4ETP53ALDH1A1HTTNPSR1 | |
| SCHEMBL5032531 | 0.92 | KDM4E (0.41) | KDM4ETP53ALDH1A1HTTNPSR1 | |
| SCHEMBL14190174 | 0.90 | CYP3A4 (0.48) | ALDH1A1HTTSMN1; SMN2RAB9AKMT2A | |
| SCHEMBL5036024 | 0.86 | ALDH1A1 (0.37) | KDM4ETP53ALDH1A1HTTNPSR1 | |
| SCHEMBL5034815 | 0.86 | KDM4E (0.43) | KDM4ETP53ALDH1A1HTTNPSR1 | |
| SCHEMBL5035132 | 0.84 | KDM4E (0.45) | KDM4ETP53ALDH1A1HTTNPSR1 | |
| SCHEMBL5032616 | 0.84 | KDM4E (0.41) | KDM4ETP53ALDH1A1HTTNPSR1 | |
| SCHEMBL5486463 | 0.83 | CYP3A4 (0.49) | KDM4EALDH1A1HTTNPSR1SMN1; SMN2 | |
| SCHEMBL5035876 | 0.82 | CYP3A4 (0.50) | ALDH1A1HTTNPSR1SMN1; SMN2RAB9A | |
| SCHEMBL5032626 | 0.82 | CYP3A4 (0.47) | KDM4EALDH1A1HTTSMN1; SMN2RAB9A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7371751-B2 | Thiazole derivatives | HOFFMANN-LA ROCHE INC. (US) | 2008-05-13 | — | — | US | disclosed |
| US-7371751-B2 | Thiazole derivatives | HOFFMANN-LA ROCHE INC. (US) | 2008-05-13 | — | — | US | disclosed |
| US-7371751-B2 | Thiazole derivatives | HOFFMANN-LA ROCHE INC. (US) | 2008-05-13 | — | — | US | disclosed |
| EP-1694673-B1 | THIAZOLE DERIVATES | HOFFMANN LA ROCHE (CH) | 2008-01-16 | — | — | EP | disclosed |