Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.46 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CCR6 | P51684 | 1/20 | 0.42 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8359906 | 0.88 | ALDH1A1 (0.50) | ALDH1A1MAPK1L3MBTL1MAPTHPGD | |
| SCHEMBL27679531 | 0.85 | APP (0.38) | ALDH1A1MAPK1L3MBTL1MAPTHPGD | |
| SCHEMBL14636294 | 0.81 | ALDH1A1 (0.44) | ALDH1A1MAPK1L3MBTL1MAPTHPGD | |
| SCHEMBL842400 | 0.80 | ALDH1A1 (0.45) | ALDH1A1MAPK1L3MBTL1MAPTHPGD | |
| SCHEMBL8923844 | 0.80 | ALDH1A1 (0.56) | ALDH1A1MAPK1L3MBTL1MAPTHPGD | |
| SCHEMBL111605 | 0.79 | ALDH1A1 (0.68) | ALDH1A1MAPK1L3MBTL1MAPTHPGD | |
| SCHEMBL1871761 | 0.79 | ALDH1A1 (0.68) | ALDH1A1MAPK1L3MBTL1MAPTHPGD | |
| Benzyl Dimethylcarbamate SCHEMBL14031385 | 0.78 | ALDH1A1 (0.62) | ALDH1A1MAPK1L3MBTL1MAPTHPGD | |
| SCHEMBL27168266 | 0.78 | ALDH1A1 (0.66) | ALDH1A1MAPK1L3MBTL1MAPTHPGD | |
| Benzyl Dimethylcarbamate SCHEMBL20401678 | 0.78 | ALDH1A1 (0.62) | ALDH1A1MAPK1L3MBTL1MAPTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-101421268-B | As the pyrazolo quinolone of effective PARP inhibitor | ABBVIE (US) | 2016-01-06 | — | — | CN | disclosed |