Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | CASR | P41180 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | PTGES | O14684 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | LPAR1 | Q92633 | 4/20 | 0.48 |
| ▸ | LPAR5 | Q9H1C0 | 3/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | NPY5R | Q15761 | 4/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9082212 | 0.89 | ALDH1A1 (0.58) | ALDH1A1NPSR1PTGESTSHRLPAR1 | |
| SCHEMBL9079600 | 0.86 | LPAR1 (0.56) | ALDH1A1KDM4EPTGESTSHRLPAR1 | |
| SCHEMBL9081212 | 0.84 | LPAR1 (0.49) | ALDH1A1KDM4ECASRNPSR1PTGES | |
| SCHEMBL9082353 | 0.83 | LPAR1 (0.59) | LPAR1LPAR5 | |
| SCHEMBL9081148 | 0.83 | KDM4E (0.51) | ALDH1A1KDM4EPTGESLPAR1LPAR5 | |
| SCHEMBL9080869 | 0.82 | TSHR (0.53) | ALDH1A1KDM4ECASRNPSR1PTGES | |
| SCHEMBL9081533 | 0.82 | ALDH1A1 (0.54) | ALDH1A1KDM4ECASRNPSR1PTGES | |
| SCHEMBL9081514 | 0.82 | KDM4E (0.66) | ALDH1A1KDM4ECASRPTGESTSHR | |
| SCHEMBL9082678 | 0.82 | LPAR1 (0.48) | ALDH1A1KDM4ELPAR1LPAR5 | |
| SCHEMBL9080500 | 0.81 | LPAR1 (0.52) | ALDH1A1KDM4EPTGESTSHRLPAR1 |
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-1996034851-A1 | BENZENE, PYRIDINE, NAPHTALENE OR BENZOPHENONE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE | ABBOTT LABORATORIES (US) | 1996-11-07 | — | — | WO | disclosed |