Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA2D1 | P54289 | 6/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | NPY1R | P25929 | 1/20 | 0.44 |
| ▸ | NPY2R | P49146 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL25776063 | 0.77 | CYP2D6 (0.54) | KDM4ESMN1; SMN2ATMLMNATSHR | |
| SCHEMBL6979700 | 0.75 | KDM4E (0.60) | CACNA2D1KDM4ESMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL24172788 | 0.73 | CACNA2D1 (0.73) | CACNA2D1KDM4E | |
| SCHEMBL3816839 | 0.73 | KDM4E (0.57) | CACNA2D1KDM4ESMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL13725597 | 0.73 | KDM4E (0.61) | CACNA2D1KDM4ESMN1; SMN2LMNATSHR | |
| SCHEMBL24172694 | 0.72 | CACNA2D1 (1.00) | CACNA2D1 | |
| SCHEMBL453901 | 0.71 | KDM4E (0.54) | CACNA2D1KDM4ESMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL1101889 | 0.70 | KDM4E (0.66) | KDM4ELMNATSHRALDH1A1MAPT | |
| SCHEMBL18017411 | 0.70 | HDAC6 (0.71) | KDM4ESMN1; SMN2ATMLMNATSHR | |
| SCHEMBL13616672 | 0.70 | KDM4E (0.53) | CACNA2D1KDM4ELMNATSHRALDH1A1 |
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-2488520-A1 | CONDENSED AZINE - DERIVATIVES FOR THE TREATMENT OF DISEASES RELATED TO THE ACETYLCHOLINE RECEPTOR | MSD Oss B.V. (NL) | 2012-08-22 | — | — | EP | disclosed |
| WO-2011045258-A1 | CONDENSED AZINE - DERIVATIVES FOR THE TREATMENT OF DISEASES RELATED TO THE ACETYLCHOLINE RECEPTOR | N.V. ORGANON (NL) | 2011-04-21 | — | — | WO | disclosed |