Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27908333 | 0.83 | ALDH1A1 (0.42) | ALDH1A1TSHRMAPK1L3MBTL1LMNA | |
| SCHEMBL11472040 | 0.79 | AKR1B1 (0.38) | ALDH1A1TSHRMAPK1CYP3A4TDP1 | |
| SCHEMBL8960248 | 0.78 | TSHR (0.41) | ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL8394513 | 0.77 | KCNH2 (0.46) | LMNASIGMAR1 | |
| SCHEMBL4008621 | 0.77 | ATM (0.41) | ALDH1A1TSHRMAPK1CYP3A4TDP1 | |
| SCHEMBL1984197 | 0.75 | TSHR (0.45) | ALDH1A1TSHRMAPK1LMNANPC1 | |
| SCHEMBL20657331 | 0.74 | ALDH1A1 (0.55) | ALDH1A1TSHRCYP3A4HPGDLMNA | |
| SCHEMBL8392441 | 0.73 | KCNH2 (0.41) | TDP1 | |
| SCHEMBL6002413 | 0.73 | LTA4H (0.41) | ALDH1A1TSHRMAPK1CYP3A4TDP1 | |
| SCHEMBL12762248 | 0.73 | CETP (0.43) | ALDH1A1TSHRMAPK1CYP3A4TDP1 |
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 |