Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | FLT1 | P17948 | 1/20 | 0.35 |
| ▸ | FLT4 | P35916 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5041208 | 0.94 | CYP3A4 (0.41) | CYP3A4TSHRALDH1A1MAPTFLT1 | |
| SCHEMBL5032515 | 0.93 | CYP3A4 (0.41) | CYP3A4TSHRALDH1A1MAPTFLT1 | |
| SCHEMBL5034722 | 0.93 | CYP3A4 (0.44) | CYP3A4TSHRMAPK1ALDH1A1MAPT | |
| SCHEMBL14190174 | 0.90 | CYP3A4 (0.48) | CYP3A4ALDH1A1MAPTHTTL3MBTL1 | |
| SCHEMBL5039107 | 0.90 | CYP3A4 (0.38) | CYP3A4TSHRMAPK1ATMALDH1A1 | |
| SCHEMBL5039048 | 0.88 | CYP3A4 (0.43) | CYP3A4TSHRMAPK1ALDH1A1MAPT | |
| SCHEMBL5032525 | 0.87 | CRHR1 (0.39) | CYP3A4TSHRALDH1A1MAPTFLT1 | |
| SCHEMBL14190166 | 0.86 | CYP3A4 (0.37) | CYP3A4TSHRALDH1A1MAPTFLT1 | |
| SCHEMBL5035199 | 0.86 | CYP3A4 (0.39) | CYP3A4TSHRMAPK1ALDH1A1MAPT | |
| SCHEMBL5038846 | 0.85 | CYP3A4 (0.39) | CYP3A4TSHRALDH1A1MAPTFLT1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |