Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MMP12 | P39900 | 3/20 | 0.46 |
| ▸ | MMP13 | P45452 | 3/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | MMP14 | P50281 | 1/20 | 0.46 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.46 |
| ▸ | MME | P08473 | 4/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | CPA1 | P15085 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11837906 | 0.86 | ALDH1A1 (0.45) | ALDH1A1TDP1CYP1A2TSHRMMP12 | |
| SCHEMBL11827360 | 0.86 | ALDH1A1 (0.53) | ALDH1A1TDP1CYP1A2TSHRADAMTS4 | |
| SCHEMBL11830848 | 0.84 | ALDH1A1 (0.53) | ALDH1A1TDP1TSHRADAMTS4 | |
| SCHEMBL11824795 | 0.80 | ADAMTS4 (0.52) | ALDH1A1TDP1CYP1A2TSHRADAMTS4 | |
| SCHEMBL11831724 | 0.80 | ADAMTS4 (0.52) | ALDH1A1TDP1CYP1A2TSHRADAMTS4 | |
| SCHEMBL11827676 | 0.79 | MME (0.48) | ALDH1A1TDP1CYP1A2TSHRMMP12 | |
| SCHEMBL379630 | 0.78 | MMP12 (0.70) | TSHRMMP12MMP13MMP2MMP9 | |
| SCHEMBL6800633 | 0.78 | MMP12 (0.70) | TSHRMMP12MMP13MMP2MMP9 | |
| SCHEMBL11824499 | 0.78 | MME (0.62) | MMP12MMP13MMP2MMP9MMP14 | |
| SCHEMBL11836224 | 0.78 | MME (0.62) | MMP12MMP13MMP2MMP9MMP14 |
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 |