Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CDC7 | O00311 | 1/20 | 0.37 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.36 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5195687 | 0.87 | CYP1A2 (0.47) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL5193746 | 0.86 | CYP3A4 (0.52) | CYP3A4CYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL5195341 | 0.84 | CYP1A2 (0.44) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL5197734 | 0.76 | POLB (0.49) | CYP1A2CYP2C19TSHRTP53TRPM8 | |
| SCHEMBL5195844 | 0.75 | DHODH (0.49) | CYP1A2CYP2C9CYP2C19CYP2D6TP53 | |
| SCHEMBL3812070 | 0.75 | CYP3A4 (0.43) | CYP3A4CYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL5196998 | 0.74 | CYP1A2 (0.48) | CYP1A2CYP2C9CYP2C19TSHRCYP2D6 | |
| SCHEMBL5196165 | 0.73 | MAPT (0.45) | CYP1A2CYP2C9CYP2C19TP53TRPM8 | |
| SCHEMBL5195339 | 0.71 | CYP1A2 (0.46) | CYP1A2CYP2C9CYP2C19TSHRCYP2D6 | |
| SCHEMBL3811165 | 0.71 | CYP3A4 (0.41) | CYP3A4CYP1A2CYP2C9CYP2C19TSHR |
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-1321463-B1 | Thiazole derivatives and their use for the treatment or prevention of Flavivirus infections | VIROCHEM PHARMA INC (CA) | 2007-08-08 | — | — | EP | claimed |