Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | FLT1 | P17948 | 1/20 | 0.34 |
| ▸ | FLT4 | P35916 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | QPCT | Q16769 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL5034781 | 0.94 | CYP3A4 (0.42) | CYP3A4TSHRGAANPSR1NPC1 | |
| SCHEMBL5041346 | 0.89 | CYP3A4 (0.39) | CYP3A4TSHRMCHR1GAANPSR1 | |
| SCHEMBL5035001 | 0.89 | CYP3A4 (0.41) | CYP3A4TSHRGAANPSR1FLT1 | |
| SCHEMBL5032683 | 0.87 | CYP3A4 (0.37) | CYP3A4TSHRGAANPSR1SMN1; SMN2 | |
| SCHEMBL5032460 | 0.85 | CYP3A4 (0.46) | CYP3A4TSHRGAANPSR1NPC1 | |
| SCHEMBL5039107 | 0.84 | CYP3A4 (0.38) | CYP3A4TSHRMCHR1GAANPSR1 | |
| SCHEMBL5039337 | 0.84 | CYP3A4 (0.34) | CYP3A4TSHRGAANPSR1FLT1 | |
| SCHEMBL5032529 | 0.83 | CYP3A4 (0.43) | CYP3A4TSHRGAANPSR1NPC1 | |
| SCHEMBL5038846 | 0.82 | CYP3A4 (0.39) | CYP3A4TSHRMCHR1GAANPSR1 | |
| SCHEMBL5032602 | 0.81 | CYP3A4 (0.40) | CYP3A4TSHRMCHR1GAANPSR1 |
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 |