Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G1B | P04054 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.53 |
| ▸ | MAPT | P10636 | 6/20 | 0.53 |
| ▸ | MEN1 | O00255 | 5/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11526512 | 0.87 | CYP3A4 (0.62) | PLA2G1BCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL794440 | 0.86 | TSHR (0.57) | PLA2G1BCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL30597995 | 0.86 | TSHR (0.57) | PLA2G1BCYP1A2CYP3A4CYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL3395744 | 0.84 | TSHR (0.56) | PLA2G1BCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL23617483 | 0.82 | CYP3A4 (0.57) | PLA2G1BCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27543438 | 0.82 | CYP3A4 (0.57) | PLA2G1BCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27511192 | 0.81 | ABL1 (0.55) | PLA2G1BCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL29894652 | 0.80 | CYP3A4 (0.56) | PLA2G1BCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL20714855 | 0.80 | CYP3A4 (0.56) | PLA2G1BCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5025346 | 0.80 | CYP3A4 (0.56) | PLA2G1BCYP1A2CYP3A4CYP2D6CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107207515-B | Pyrazine compounds for the treatment of infectious diseases | 豪夫迈·罗氏有限公司 | 2019-05-28 | — | — | CN | disclosed |
| CN-107207515-A | Pyrazine compounds for the treatment of infectious diseases | 豪夫迈·罗氏有限公司 | 2017-09-26 | — | — | CN | disclosed |