Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HMGCR | P04035 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL8961301 | 0.83 | HMGCR (0.36) | CYP3A4GAAHMGCR | |
| SCHEMBL8800000 | 0.83 | POLB (0.43) | CYP3A4CYP2C9CYP2C19POLBTSHR | |
| SCHEMBL27816008 | 0.81 | CYP3A4 (0.42) | CYP3A4CYP2C9CYP2C19POLBTSHR | |
| SCHEMBL7470858 | 0.81 | CYP3A4 (0.39) | CYP3A4CYP2C9CYP2C19POLBTSHR | |
| SCHEMBL9614470 | 0.76 | TSHR (0.50) | CYP3A4CYP2C9CYP2C19POLBTSHR | |
| SCHEMBL319717 | 0.76 | TSHR (0.42) | CYP3A4CYP2C9CYP2C19POLBTSHR | |
| SCHEMBL7474281 | 0.75 | CYP2C9 (0.38) | CYP3A4CYP2C9CYP2C19POLBTSHR | |
| SCHEMBL8961408 | 0.75 | LMNA (0.38) | CYP2C19 | |
| SCHEMBL13334734 | 0.74 | GAA (0.40) | CYP3A4CYP2C9CYP2C19POLBTSHR | |
| SCHEMBL28817638 | 0.74 | CYP3A4 (0.40) | CYP3A4CYP2C9CYP2C19POLBTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5532402-A | Process for producing optically active hydroxyalkylphosphonates | TAKASAGO INTERNATIONAL CORPORATION (JP) | 1996-07-02 | — | — | US | disclosed |