Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 4/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | ACE | P12821 | 1/20 | 0.35 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4803328 | 0.89 | PLA2G2C (0.40) | EPHX2HRH3TSHREPHX1SMN1; SMN2 | |
| SCHEMBL4800510 | 0.89 | PLA2G2C (0.40) | EPHX2HRH3TSHREPHX1SMN1; SMN2 | |
| SCHEMBL3655319 | 0.81 | HRH3 (0.41) | EPHX2HRH3TSHREPHX1SMN1; SMN2 | |
| SCHEMBL5503198 | 0.79 | HRH3 (0.39) | HRH3TSHREPHX1SMN1; SMN2GAA | |
| SCHEMBL8303908 | 0.79 | HRH3 (0.43) | EPHX2HRH3TSHREPHX1SMN1; SMN2 | |
| SCHEMBL9822667 | 0.79 | ALDH1A1 (0.41) | EPHX2HRH3TSHREPHX1SMN1; SMN2 | |
| SCHEMBL13506436 | 0.78 | HRH3 (0.46) | EPHX2HRH3TSHREPHX1SMN1; SMN2 | |
| SCHEMBL13387471 | 0.78 | HRH3 (0.46) | EPHX2HRH3TSHREPHX1SMN1; SMN2 | |
| SCHEMBL12139098 | 0.78 | HDAC4 (0.46) | EPHX2EPHX1GAACTSK | |
| SCHEMBL1414236 | 0.78 | HDAC4 (0.46) | EPHX2EPHX1GAACTSK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1966198-A1 | 2-AMINO-3,4-DIHYDRO-PYRIDOÝ3,4-D¨PYRIMIDINE DERIVATIVES USEFUL AS INHIBITORS OF BETA-SECRETASE (BACE) | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-09-10 | — | — | EP | disclosed |
| WO-2007050612-A1 | 2-AMINO-3,4-DIHYDRO-PYRIDO[3,4-D]PYRIMIDINE DERIVATIVES USEFUL AS INHIBITORS OF BETA-SECRETASE (BACE) | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-05-03 | — | — | WO | disclosed |