Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | HRH2 | P25021 | 6/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 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 | |
|---|---|---|---|---|
| SCHEMBL18256087 | 0.92 | ALDH1A1 (0.43) | ALDH1A1GAATP53THRBHRH2 | |
| SCHEMBL263398 | 0.84 | ALDH1A1 (0.45) | ALDH1A1GAATP53THRBHRH2 | |
| SCHEMBL13566386 | 0.82 | ALDH1A1 (0.39) | ALDH1A1GAATP53THRBHRH2 | |
| SCHEMBL13309407 | 0.82 | ALDH1A1 (0.39) | ALDH1A1GAATP53THRBHRH2 | |
| SCHEMBL2095796 | 0.81 | ALDH1A1 (0.38) | ALDH1A1GAATP53THRBHRH2 | |
| SCHEMBL2091446 | 0.78 | ALDH1A1 (0.39) | ALDH1A1GAATP53THRBHRH2 | |
| SCHEMBL10284723 | 0.78 | ALDH1A1 (0.41) | ALDH1A1GAATP53THRBHRH2 | |
| SCHEMBL95057 | 0.74 | — | — | |
| SCHEMBL20749124 | 0.73 | ALDH1A1 (0.40) | ALDH1A1HRH2CYP1A2HRH1HRH4 | |
| SCHEMBL10282380 | 0.73 | ALDH1A1 (0.42) | ALDH1A1GAATP53THRBHRH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6204293-B1 | INHIBITING POST-TRANSLATIONAL MODIFICATION OF THE ONCOGENIC RAS PROTEIN BY PROTEIN FARNESYLTRANSFERASE, PROTEIN GERANYLGERANYLTRANSFERASE, OR BOTH | UNIVERSITY OF PITTSBURGH | 2001-03-20 | — | — | US | disclosed |
| WO-1998050031-A1 | INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES | UNIVERSITY OF PITTSBURGH (US) | 1998-11-12 | — | — | WO | disclosed |