Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A3 | P43003 | 2/20 | 0.35 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.35 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | LAP3 | P28838 | 1/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.31 |
| ▸ | GABRP | O00591 | 2/20 | 0.30 |
| ▸ | GABRD | O14764 | 2/20 | 0.30 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.30 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.30 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3637938 | 0.80 | MEN1 (0.35) | ALDH1A1MEN1CYP1A2THRBKMT2A | |
| SCHEMBL7344236 | 0.79 | GABRP (0.48) | SLC1A3SLC1A2SLC1A1ALDH1A1MEN1 | |
| SCHEMBL7872141 | 0.76 | ALDH1A1 (0.44) | SLC1A3SLC1A2SLC1A1ALDH1A1MEN1 | |
| SCHEMBL27777133 | 0.76 | ALDH1A1 (0.44) | SLC1A3SLC1A2SLC1A1ALDH1A1MEN1 | |
| SCHEMBL3391927 | 0.75 | SLC1A2 (0.38) | SLC1A3SLC1A2SLC1A1ALDH1A1KIF11 | |
| SCHEMBL8725998 | 0.75 | ALDH1A1 (0.32) | ALDH1A1MEN1CYP1A2THRBKMT2A | |
| SCHEMBL3053287 | 0.74 | SLC1A2 (0.47) | SLC1A3SLC1A2SLC1A1MEN1KMT2A | |
| SCHEMBL8584362 | 0.73 | SLC1A3 (0.37) | SLC1A3SLC1A2SLC1A1ALDH1A1MEN1 | |
| SCHEMBL1959317 | 0.73 | MEN1 (0.31) | ALDH1A1MEN1CYP1A2THRBKMT2A | |
| Ammonia Solution, Strong SCHEMBL27674351 | 0.73 | MEN1 (0.31) | ALDH1A1MEN1CYP1A2THRBKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4840949-A | Oxadiazole-alkyl-purine derivatives useful as antitussive agents | CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) | 1989-06-20 | — | — | US | disclosed |