Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | KAT7 | O95251 | 1/20 | 0.32 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.32 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.32 |
| ▸ | KAT8 | Q9H7Z6 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27624078 | 0.65 | HPGD (0.36) | ALDH1A1KDM4EKMT2AMAPTGAA | |
| SCHEMBL4659266 | 0.64 | ABCC9 (0.40) | ALDH1A1KDM4EKAT7KAT6AKAT5 | |
| SCHEMBL3854458 | 0.63 | ALDH1A1 (0.50) | ALDH1A1KDM4EKMT2AGAA | |
| SCHEMBL23124196 | 0.63 | IMPDH2 (0.37) | — | |
| SCHEMBL8560391 | 0.62 | TDP1 (0.40) | ALDH1A1KDM4EKAT7KAT6AKAT5 | |
| SCHEMBL27785439 | 0.62 | KAT7 (0.37) | KAT7KAT6AKAT5KAT8KMT2A | |
| SCHEMBL9095381 | 0.60 | NAMPT (0.34) | — | |
| SCHEMBL10044450 | 0.60 | RXFP1 (0.59) | ALDH1A1KDM4EKMT2AMAPTGAA | |
| SCHEMBL3857993 | 0.60 | ALDH1A1 (0.64) | ALDH1A1KMT2AMAPT | |
| Hydrochloric Acid SCHEMBL27576989 | 0.59 | HDAC8 (0.36) | — |
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-2001849-A1 | PYRIDINE AND PYRIMIDINE DERIVATIVES AS MGLUR2 ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2008-12-17 | — | — | EP | disclosed |
| WO-2007110337-A1 | PYRIDINE AND PYRIMIDINE DERIVATIVES AS MGLUR2 ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-10-04 | — | — | WO | disclosed |