Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 2/20 | 0.44 |
| ▸ | NCK1 | P16333 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.38 |
| ▸ | PI4KA | P42356 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.38 |
| ▸ | SLC14A1 | Q13336 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 3/20 | 0.35 |
| ▸ | MAOB | P27338 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9097968 | 0.85 | ADORA3 (0.46) | ADORA3SLC6A3BACE1PIK3CDPIP5K1C | |
| SCHEMBL9097907 | 0.81 | ADORA3 (0.50) | ADORA3SLC6A3BACE1MAPTRAB9A | |
| SCHEMBL28439182 | 0.73 | HSP90AA1 (0.50) | BACE1NCK1CYP1A2AKR1B1MAPT | |
| SCHEMBL9098237 | 0.71 | HTT (0.51) | ADORA3SLC6A3MAPTALDH1A1MAOA | |
| SCHEMBL20921204 | 0.71 | CYP1A2 (0.55) | BACE1NCK1CYP1A2ALDH1A1KDM4E | |
| SCHEMBL9097754 | 0.68 | BACE1 (0.46) | BACE1NCK1CYP1A2MAPTRAB9A | |
| SCHEMBL9099556 | 0.67 | BACE1 (0.44) | BACE1NCK1CYP1A2MAPTRAB9A | |
| SCHEMBL8903789 | 0.66 | LOX (0.56) | ADORA3SLC6A3KDM4EMAOAMAOB | |
| SCHEMBL1062382 | 0.64 | ADORA3 (0.75) | ADORA3SLC6A3MAOALOXL2LOX | |
| Thiazolsulfone SCHEMBL152559 | 0.64 | ADORA3 (1.00) | ADORA3SLC6A3CYP1A2ALDH1A1LOXL2 |
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-1996030370-A2 | THIAZOLE AND THIADIAZOLE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS USEFUL IN THE TREATMENT OF THROMBOCYTOPENIA | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-10-03 | — | — | WO | disclosed |