Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.40 |
| ▸ | USP7 | Q93009 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ATR | Q13535 | 2/20 | 0.39 |
| ▸ | CDC7 | O00311 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4307232 | 0.79 | NR1H2 (0.43) | ALDH1A1KDM4EHPGDLMNATSHR | |
| SCHEMBL25422381 | 0.77 | USP7 (0.51) | KDM4ENR1H2NR1H3HDAC1HDAC6 | |
| SCHEMBL14917474 | 0.75 | CHEK2 (0.43) | CHEK2MKNK1ATRCDC7MAP4K4 | |
| SCHEMBL16739607 | 0.72 | ADORA2A (0.44) | ALDH1A1KDM4EHPGDLMNAL3MBTL1 | |
| SCHEMBL28755801 | 0.72 | SCN9A (0.39) | ALDH1A1KDM4EHPGDLMNATSHR | |
| SCHEMBL28790251 | 0.72 | NFKB1 (0.44) | ALDH1A1KDM4EHPGDCHEK2MKNK1 | |
| SCHEMBL6266210 | 0.71 | TRPV1 (0.44) | ALDH1A1KDM4EHPGDLMNATSHR | |
| SCHEMBL1340108 | 0.70 | L3MBTL1 (0.47) | KDM4ENR1H2NR1H3L3MBTL1USP7 | |
| SCHEMBL4776531 | 0.69 | FABP4 (0.46) | ALDH1A1KDM4EHPGDLMNATSHR | |
| SCHEMBL31368730 | 0.69 | MKNK1 (0.46) | ALDH1A1KDM4EMKNK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3071553-A1 | SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS | PTC Therapeutics, Inc. (US) | 2016-09-28 | — | — | EP | disclosed |
| WO-2015076800-A1 | SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS | PTC THERAPEUTICS, INC. (US) | 2015-05-28 | — | — | WO | disclosed |