Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.74 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.74 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.74 |
| ▸ | HPGD | P15428 | 2/20 | 0.74 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.74 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.52 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7592799 | 0.98 | CYP1A2 (0.71) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL6266551 | 0.87 | CYP1A2 (0.70) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL16680291 | 0.85 | CYP1A2 (0.56) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL16680290 | 0.85 | CYP1A2 (0.56) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL15684679 | 0.85 | CYP1A2 (1.00) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL16679790 | 0.83 | CYP1A2 (0.54) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL6202510 | 0.83 | CYP1A2 (0.97) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL16679788 | 0.83 | CYP1A2 (0.54) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL8074161 | 0.80 | CYP1A2 (0.66) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 | |
| SCHEMBL8074159 | 0.80 | CYP1A2 (0.66) | CYP1A2CYP2C19CYP2C9HPGDMAPK1 |
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-7459467-B2 | Manufacturing process for methyl phenidate and intermediates thereof | IPCA LABORATORIES, LTD. (IN) | 2008-12-02 | — | — | US | disclosed |