Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 11/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 15/20 | 0.62 |
| ▸ | MAPT | P10636 | 7/20 | 0.59 |
| ▸ | CASP1 | P29466 | 6/20 | 0.59 |
| ▸ | GAA | P10253 | 4/20 | 0.59 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.51 |
| ▸ | HPGD | P15428 | 8/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | CASP7 | P55210 | 4/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL1718130 | 0.85 | MAPT (0.61) | KDM4EALDH1A1MAPTCASP1GAA | |
| SCHEMBL1718270 | 0.85 | KDM4E (0.68) | KDM4EALDH1A1MAPTCASP1GAA | |
| SCHEMBL1720229 | 0.85 | KDM4E (0.73) | KDM4EALDH1A1MAPTCASP1GAA | |
| SCHEMBL1718037 | 0.83 | KDM4E (0.70) | KDM4EALDH1A1MAPTCASP1GAA | |
| SCHEMBL1718627 | 0.83 | MAPT (0.59) | KDM4EALDH1A1MAPTCASP1GAA | |
| SCHEMBL1718508 | 0.82 | KDM4E (0.69) | KDM4EALDH1A1MAPTCASP1GAA | |
| SCHEMBL2543331 | 0.82 | ALDH1A1 (0.74) | KDM4EALDH1A1MAPTCASP1GAA | |
| SCHEMBL1719500 | 0.82 | KDM4E (0.68) | KDM4EALDH1A1MAPTCASP1GAA | |
| SCHEMBL1719012 | 0.82 | KDM4E (0.71) | KDM4EALDH1A1MAPTCASP1GAA | |
| SCHEMBL1718032 | 0.82 | KDM4E (0.71) | KDM4EALDH1A1MAPTCASP1GAA |
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 |