Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | CPA1 | P15085 | 3/20 | 0.39 |
| ▸ | PPARA | Q07869 | 2/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11827041 | 0.86 | PDCD1 (0.43) | ADAMTS4ALDH1A1TDP1PDCD1CD274 | |
| SCHEMBL11824795 | 0.85 | ADAMTS4 (0.52) | ADAMTS4ALDH1A1TDP1CYP1A2PDCD1 | |
| SCHEMBL11839163 | 0.80 | MEN1 (0.49) | CYP1A2MEN1KMT2ATSHR | |
| SCHEMBL11830412 | 0.80 | ALDH1A1 (0.54) | ADAMTS4ALDH1A1TDP1CYP1A2TSHR | |
| SCHEMBL11837755 | 0.79 | ALDH1A1 (0.43) | ALDH1A1KMT2ATRPA1CPA1PPARA | |
| SCHEMBL11827701 | 0.79 | MME (0.50) | TDP1MEN1KMT2ATRPA1PPARA | |
| SCHEMBL11837592 | 0.77 | ALDH1A1 (0.54) | ADAMTS4ALDH1A1TDP1CYP1A2AURKA | |
| SCHEMBL11830848 | 0.76 | ALDH1A1 (0.53) | ADAMTS4ALDH1A1TDP1AURKAGSK3A | |
| SCHEMBL11827360 | 0.76 | ALDH1A1 (0.53) | ADAMTS4ALDH1A1TDP1CYP1A2AURKA | |
| SCHEMBL11672909 | 0.76 | ALDH1A1 (0.60) | ADAMTS4ALDH1A1TDP1CYP1A2MEN1 |
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-3966801-A | ANTIINFLAMMATORY AGENTS | WILLIAM H. RORER, INC. (US) | 1976-06-29 | — | — | US | disclosed |