Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4668053 | 0.69 | CHRM2 (0.43) | CXCR3GRIN2BHSD11B1KDM4E | |
| SCHEMBL17033077 | 0.68 | HRH3 (0.44) | HRH3ALDH1A1POLBMAPTLMNA | |
| SCHEMBL15047582 | 0.67 | CHRM2 (0.41) | CXCR3GRIN2BHSD11B1KDM4E | |
| SCHEMBL12093086 | 0.66 | ALDH1A1 (0.48) | GRIN2BALDH1A1HSD11B1KDM4EP2RX7 | |
| SCHEMBL27053801 | 0.64 | LMNA (0.60) | HRH3POLBMAPTCYP46A1LMNA | |
| SCHEMBL8105427 | 0.63 | HIF1A (0.51) | CXCR3HRH3 | |
| SCHEMBL8103937 | 0.63 | HIF1A (0.51) | CXCR3HRH3 | |
| SCHEMBL21611373 | 0.63 | TRPA1 (0.50) | GRIN2BALDH1A1KDM4ECYP46A1LMNA | |
| SCHEMBL20070184 | 0.63 | CYP46A1 (0.56) | HRH3GRIN2BCYP46A1LMNAGAA | |
| SCHEMBL28849416 | 0.63 | MAPT (0.43) | HRH3ALDH1A1HSD11B1KDM4EPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000026190-A1 | CHIRAL AMINO ALCOHOL DERIVATIVES OF PYRIDINE, A METHOD FOR THE MANUFACTURE THEREOF AND THEIR USE AS CATALYSTS | NESTE CHEMICALS OY (FI) | 2000-05-11 | — | — | WO | claimed |