Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14748211 | 0.79 | EPHX1 (0.46) | NPSR1EPHX2SMN1; SMN2HPGDKMT2A | |
| SCHEMBL1966308 | 0.73 | GLA (0.38) | ALDH1A1 | |
| SCHEMBL1965522 | 0.70 | KDM4E (0.34) | — | |
| SCHEMBL1698336 | 0.68 | NPSR1 (1.00) | NPSR1EPHX2SMN1; SMN2HPGDKMT2A | |
| SCHEMBL10254229 | 0.68 | NPSR1 (0.67) | NPSR1EPHX2SMN1; SMN2HPGDKMT2A | |
| SCHEMBL2097679 | 0.68 | NPSR1 (1.00) | NPSR1EPHX2SMN1; SMN2HPGDKMT2A | |
| SCHEMBL2091358 | 0.68 | NPSR1 (1.00) | NPSR1EPHX2SMN1; SMN2HPGDKMT2A | |
| SCHEMBL1698397 | 0.67 | EPHX1 (0.76) | NPSR1EPHX2SMN1; SMN2HPGDKMT2A | |
| SCHEMBL14748235 | 0.67 | HPGD (0.63) | NPSR1EPHX2SMN1; SMN2HPGDKMT2A | |
| SCHEMBL3075216 | 0.66 | EPHX1 (0.68) | NPSR1EPHX2SMN1; SMN2HPGDKMT2A |
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-2334657-B1 | PIPERAZINE D3 AND 5-HT2A RECEPTOR MODULATORS | HOFFMANN LA ROCHE (CH) | 2013-03-06 | — | — | EP | disclosed |