Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 6/20 | 0.38 |
| ▸ | ITGAV | P06756 | 6/20 | 0.38 |
| ▸ | JAK1 | P23458 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | RORC | P51449 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4786490 | 0.88 | TNKS (0.42) | ALDH1A1MAPK1CYP3A4 | |
| SCHEMBL4737473 | 0.82 | ITGB3 (0.35) | KCNH2ITGB3ITGAVALDH1A1GRIN2B | |
| SCHEMBL4786234 | 0.80 | DPP7 (0.39) | ALDH1A1RORCMAPK1CYP3A4 | |
| SCHEMBL3667635 | 0.78 | KMT2A (0.40) | KCNH2ALDH1A1CYP3A4 | |
| SCHEMBL8139051 | 0.76 | SMN1; SMN2 (0.53) | KCNH2JAK1CYP3A4 | |
| SCHEMBL4738420 | 0.76 | ALDH1A1 (0.39) | KCNH2ALDH1A1CYP3A4 | |
| SCHEMBL6636907 | 0.76 | KCNH2 (0.48) | KCNH2ITGB3ITGAVALDH1A1MAPK1 | |
| SCHEMBL3808885 | 0.75 | DPP7 (0.41) | ALDH1A1 | |
| SCHEMBL3670283 | 0.74 | SIGMAR1 (0.39) | ALDH1A1 | |
| SCHEMBL3727160 | 0.73 | RORC (0.38) | KCNH2ALDH1A1RORC |
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 |
|---|---|---|---|---|---|---|---|
| EP-1997805-A1 | Compounds with antiparasitic activity, applications thereof to the treatment of infectious diseases caused by apicomplexans | Commissariat à l'Energie Atomique (FR) | 2008-12-03 | — | — | EP | claimed |