Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.81 |
| ▸ | GAA | P10253 | 2/20 | 0.81 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.74 |
| ▸ | GLA | P06280 | 1/20 | 0.74 |
| ▸ | HPGD | P15428 | 6/20 | 0.68 |
| ▸ | TSHR | P16473 | 2/20 | 0.68 |
| ▸ | RAB9A | P51151 | 1/20 | 0.68 |
| ▸ | TP53 | P04637 | 3/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.53 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1718805 | 0.92 | ALDH1A1 (0.80) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL1718630 | 0.90 | ALDH1A1 (1.00) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL1717949 | 0.89 | ALDH1A1 (0.76) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL1718799 | 0.84 | ALDH1A1 (0.68) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL4211288 | 0.81 | HPGD (1.00) | ALDH1A1GAAKDM4EHPGDTSHR | |
| SCHEMBL1718260 | 0.80 | ALDH1A1 (0.68) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL1719260 | 0.79 | KDM4E (0.69) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL1719175 | 0.78 | TP53 (0.63) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL1719735 | 0.77 | HPGD (0.81) | ALDH1A1KDM4EGLAHPGDTSHR | |
| SCHEMBL1718359 | 0.76 | ALDH1A1 (0.63) | ALDH1A1KDM4EHPGDTSHRRAB9A |
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-1506196-B1 | PYRAZOLOPYRIMIDINES AS SODIUM CHANNEL INHIBITORS | ICAGEN INC (US) | 2012-01-18 | — | — | EP | claimed |
| EP-1506196-B1 | PYRAZOLOPYRIMIDINES AS SODIUM CHANNEL INHIBITORS | ICAGEN INC (US) | 2012-01-18 | — | — | EP | disclosed |