Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.54 |
| ▸ | PDE5A | O76074 | 4/20 | 0.54 |
| ▸ | ACP1 | P24666 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | GBA1 | P04062 | 2/20 | 0.49 |
| ▸ | RECQL | P46063 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.47 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4505205 | 0.99 | KDM1A (0.53) | KDM1APDE5AACP1MAPK1MAPT | |
| Hydrochloric Acid SCHEMBL4518504 | 0.85 | PDE5A (0.52) | PDE5AACP1MAPK1MAPTGBA1 | |
| SCHEMBL10065463 | 0.80 | MAPK1 (0.77) | KDM1APDE5AACP1MAPK1MAPT | |
| SCHEMBL23723245 | 0.80 | PDE5A (0.53) | PDE5AACP1MAPK1MAPTGBA1 | |
| Hydrochloric Acid SCHEMBL4502640 | 0.79 | MAPK1 (0.79) | KDM1APDE5AACP1MAPK1GBA1 | |
| SCHEMBL17770552 | 0.76 | ROCK2 (0.64) | PDE5AACP1MAPK1MAPTGBA1 | |
| Hydrochloric Acid SCHEMBL4508477 | 0.75 | PDE5A (0.43) | PDE5AACP1MAPK1MAPTGBA1 | |
| SCHEMBL20573807 | 0.74 | LATS1 (0.78) | ROCK2ROCK1PKN2 | |
| SCHEMBL4493556 | 0.74 | CYP1A2 (0.43) | PDE5AACP1MAPK1MAPTGBA1 | |
| Hydrochloric Acid SCHEMBL4494721 | 0.73 | CYP1A2 (0.43) | PDE5AACP1MAPK1MAPTGBA1 |
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-2012046207-A1 | ANTI-PARASITIC SUBSTITUTED RING FUSED AZINE COMPOUNDS | PARACO TECHNOLOGY LIMITED (NZ) | 2012-04-12 | — | — | WO | disclosed |