Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.41 |
| ▸ | NMT1 | P30419 | 1/20 | 0.34 |
| ▸ | EGLN2 | Q96KS0 | 2/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | GCGR | P47871 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | DRD1 | P21728 | 1/20 | 0.31 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.31 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3426389 | 0.89 | KCNH2 (0.43) | KCNH2NMT1EGLN2GRIN1GRIN2B | |
| SCHEMBL3396132 | 0.85 | KCNH2 (0.41) | KCNH2NMT1EGLN2GRIN1GRIN2B | |
| SCHEMBL3432960 | 0.84 | KCNH2 (0.43) | KCNH2EGLN2GCGRMAPK14DRD1 | |
| Hydrochloric Acid SCHEMBL3432843 | 0.83 | KCNH2 (0.42) | KCNH2EGLN2GCGRMAPK14DRD1 | |
| SCHEMBL3395524 | 0.82 | KCNH2 (0.39) | KCNH2EGLN2S1PR1DRD1 | |
| SCHEMBL3394274 | 0.81 | KCNH2 (0.43) | KCNH2EGLN2S1PR1 | |
| SCHEMBL3396008 | 0.81 | TNIK (0.43) | KCNH2EGLN2S1PR1DRD1 | |
| SCHEMBL3397167 | 0.81 | KCNH2 (0.42) | KCNH2EGLN2S1PR1DRD1 | |
| SCHEMBL3392062 | 0.80 | KCNH2 (0.54) | KCNH2EGLN2MAPK14 | |
| SCHEMBL3432594 | 0.80 | KCNH2 (0.40) | KCNH2EGLN2S1PR1DRD1PDE3B |
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-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |