Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KYNU | Q16719 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CCR6 | P51684 | 1/20 | 0.37 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4465319 | 0.83 | ALDH1A1 (0.56) | ALDH1A1MAPK1L3MBTL1MAPTHCAR2 | |
| SCHEMBL28045443 | 0.80 | ALDH1A1 (0.53) | ALDH1A1MAPK1L3MBTL1ABCB1MAPT | |
| SCHEMBL8359906 | 0.78 | ALDH1A1 (0.50) | ALDH1A1MAPK1L3MBTL1ABCB1MAPT | |
| SCHEMBL535708 | 0.75 | CA12 (0.49) | ALDH1A1MAPK1L3MBTL1KMT2AKYNU | |
| SCHEMBL8923844 | 0.74 | ALDH1A1 (0.56) | ALDH1A1MAPK1L3MBTL1ABCB1MAPT | |
| SCHEMBL2659132 | 0.72 | POLB (0.53) | ALDH1A1MAPK1L3MBTL1HPGDKYNU | |
| Benzyl Dimethylcarbamate SCHEMBL20401678 | 0.71 | ALDH1A1 (0.62) | ALDH1A1MAPK1L3MBTL1ABCB1MAPT | |
| Benzyl Dimethylcarbamate SCHEMBL14031385 | 0.71 | ALDH1A1 (0.62) | ALDH1A1MAPK1L3MBTL1ABCB1MAPT | |
| Benzyl Dimethylcarbamate SCHEMBL5134244 | 0.71 | ALDH1A1 (0.62) | ALDH1A1MAPK1L3MBTL1ABCB1MAPT | |
| SCHEMBL7694380 | 0.71 | ALDH1A1 (0.62) | ALDH1A1MAPK1L3MBTL1ABCB1MAPT |
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-1432707-B1 | AZABICYCLIC-SUBSTITUTED FUSED-HETEROARYL COMPOUNDS FOR THE TREATMENT OF DISEASE | PHARMACIA & UPJOHN CO LLC (US) | 2012-03-28 | — | — | EP | disclosed |