Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 14/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.35 |
| ▸ | NSD2 | O96028 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.34 |
| ▸ | MEN1 | O00255 | 5/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31053862 | 0.75 | GAA (0.45) | MAPTKMT2AGAAALDH1A1MEN1 | |
| SCHEMBL25027280 | 0.75 | GAA (0.45) | MAPTKMT2AGAAALDH1A1MEN1 | |
| SCHEMBL2483950 | 0.70 | HTR6 (0.62) | HTR6MAPTNPSR1ALDH1A1MAPK1 | |
| SCHEMBL12205169 | 0.68 | HTR6 (0.47) | HTR6MAPTGAAGLAMAPK1 | |
| SCHEMBL12205555 | 0.66 | ATM (0.43) | HTR6SMN1; SMN2MAPTKMT2AGAA | |
| SCHEMBL4721047 | 0.64 | MAPT (0.66) | HTR6MAPTKMT2ANPSR1GAA | |
| SCHEMBL12515298 | 0.62 | KAT2B (0.69) | SMN1; SMN2MAPTKMT2AGAAALDH1A1 | |
| SCHEMBL18650612 | 0.61 | MAPT (0.39) | SMN1; SMN2MAPTKMT2AGLAALDH1A1 | |
| SCHEMBL4954691 | 0.61 | ALDH1A1 (0.54) | HTR6SMN1; SMN2MAPTKMT2AGAA | |
| SCHEMBL10561726 | 0.61 | CA12 (0.58) | SMN1; SMN2MAPTKMT2AALDH1A1MEN1 |
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-1851210-B1 | NITRO-SUBSTITUTED PHENYL-PIPERAZINE COMPOUNDS, THEIR PREPARATION AND USE IN MEDICAMENTS | ESTEVE LABOR DR (ES) | 2011-10-19 | — | — | EP | disclosed |