Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 5/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21251390 | 0.76 | MAOB (0.48) | MAOBMAOAACHETDP1ALDH1A1 | |
| SCHEMBL9848313 | 0.75 | MAOB (0.43) | MAOBMAOAACHETDP1ALDH1A1 | |
| SCHEMBL10554150 | 0.74 | ALOX15 (0.42) | ACHEALDH1A1MAPTCA1CA2 | |
| SCHEMBL9617031 | 0.74 | CYP2A6 (0.42) | TDP1ALDH1A1 | |
| SCHEMBL3685814 | 0.74 | ALOX15 (0.42) | ACHEALDH1A1MAPTCA1CA2 | |
| SCHEMBL3684089 | 0.74 | ALOX15 (0.42) | ACHEALDH1A1MAPTCA1CA2 | |
| SCHEMBL9848315 | 0.73 | TP53 (0.39) | TDP1ALDH1A1CA2TSHR | |
| SCHEMBL9848314 | 0.73 | ALDH1A1 (0.36) | TDP1ALDH1A1TSHR | |
| SCHEMBL9848304 | 0.72 | MAOB (0.42) | MAOBMAOA | |
| SCHEMBL3587056 | 0.68 | MAOB (0.52) | MAOBMAOAACHETDP1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0438715-A2 | 1,1-Bicyclo-substituted fluorinated cyclopentanes and method for their production | BAYER AG (DE) | 1991-07-31 | — | — | EP | disclosed |