Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 13/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 13/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 12/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 12/20 | 0.47 |
| ▸ | TSHR | P16473 | 9/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.47 |
| ▸ | RAD52 | P43351 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 10/20 | 0.45 |
| ▸ | CLK4 | Q9HAZ1 | 6/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 7/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.44 |
| ▸ | MEN1 | O00255 | 6/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 SCHEMBL4517946 | 0.99 | RAD52 (0.47) | CYP1A2CYP3A4CYP2C19CYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL4508477 | 0.86 | PDE5A (0.43) | CYP1A2RAD52POLBMAPK1MEN1 | |
| Hydrochloric Acid SCHEMBL4510200 | 0.83 | RAD52 (0.68) | CYP1A2CYP3A4CYP2C19CYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL4518504 | 0.72 | PDE5A (0.52) | CYP1A2CYP3A4CYP2C19CYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL4506879 | 0.71 | ALDH1A1 (0.65) | RAD52POLBRXFP1MAPK1KMT2A | |
| SCHEMBL1289375 | 0.69 | KDM1A (0.54) | CYP1A2CYP3A4CYP2C19CYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL4502022 | 0.69 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2C19CYP2D6TSHR | |
| SCHEMBL23723245 | 0.69 | PDE5A (0.53) | CYP1A2RAD52POLBMAPK1MEN1 | |
| SCHEMBL16404467 | 0.68 | RAD52 (0.80) | CYP1A2CYP3A4CYP2C19CYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL4505205 | 0.68 | KDM1A (0.53) | CYP1A2CYP3A4CYP2C19CYP2D6TSHR |
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 |