Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | GPR88 | Q9GZN0 | 2/20 | 0.34 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.33 |
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | CHUK | O15111 | 1/20 | 0.33 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.33 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | PAK4 | O96013 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | PRKCG | P05129 | 1/20 | 0.33 |
| ▸ | INSR | P06213 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 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 | |
|---|---|---|---|---|
| SCHEMBL6958572 | 0.77 | LTA4H (0.37) | LTA4HPOLBGPR88ALDH1A1 | |
| SCHEMBL4716852 | 0.77 | LTA4H (0.37) | LTA4HPOLBGPR88ALDH1A1 | |
| SCHEMBL9265557 | 0.71 | LTA4H (0.36) | LTA4HPOLBSIGMAR1GPR88CALM1 | |
| SCHEMBL2206565 | 0.66 | ADRA2A (0.36) | ALDH1A1ADRA2AADRA2BADRA2CHTR2A | |
| SCHEMBL1773270 | 0.66 | ADRA2A (0.36) | ALDH1A1ADRA2AADRA2BADRA2CHTR2A | |
| SCHEMBL1773267 | 0.66 | ADRA2A (0.36) | ALDH1A1ADRA2AADRA2BADRA2CHTR2A | |
| Isopropylbenzene SCHEMBL28865209 | 0.65 | LTA4H (0.46) | LTA4HPOLBGPR88MAPK1ALDH1A1 | |
| SCHEMBL28859344 | 0.65 | TSHR (0.46) | LTA4HPOLBGPR88ALDH1A1 | |
| SCHEMBL159324 | 0.65 | LTA4H (0.46) | LTA4HPOLBGPR88ALDH1A1ADRA2A | |
| SCHEMBL14314047 | 0.65 | LTA4H (0.46) | LTA4HPOLBGPR88ALDH1A1ADRA2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0711280-A1 | PERHYDROISOINDOLE DERIVATIVES AS P SUBSTANCE ANTAGONISTS | Aventis Pharma S.A. (FR) | 1996-05-15 | — | — | EP | disclosed |
| US-5451601-A | Perhydroisoindole derivatives and pharmaceutical compositions containing them | RHONE-POULENC RORER S.A. (FR) | 1995-09-19 | — | — | US | disclosed |
| WO-1995004040-A1 | PERHYDROISOINDOLE DERIVATIVES AS P SUBSTANCE ANTAGONISTS | RHONE-POULENC RORER S.A. (FR) | 1995-02-09 | — | — | WO | disclosed |