Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 2/20 | 0.37 |
| ▸ | ADH1C | P00326 | 2/20 | 0.37 |
| ▸ | ADH1A | P07327 | 2/20 | 0.37 |
| ▸ | ADH4 | P08319 | 1/20 | 0.31 |
| ▸ | ADH7 | P40394 | 1/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | MMP3 | P08254 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | MMP13 | P45452 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9322609 | 0.76 | — | — | |
| SCHEMBL2259950 | 0.72 | TSHR (0.52) | — | |
| SCHEMBL8720750 | 0.71 | — | — | |
| SCHEMBL31573806 | 0.70 | TDP1 (0.38) | MMP1MMP2MMP3MMP9MMP13 | |
| SCHEMBL5173210 | 0.70 | — | — | |
| SCHEMBL7229497 | 0.69 | TSHR (0.35) | MMP1MMP2MMP3MMP9MMP13 | |
| SCHEMBL22558 | 0.69 | — | — | |
| SCHEMBL7237664 | 0.69 | TSHR (0.35) | MMP1MMP2MMP3MMP9MMP13 | |
| SCHEMBL417149 | 0.68 | CYP19A1 (0.33) | MMP1MMP2MMP3MMP9MMP13 | |
| SCHEMBL11014727 | 0.67 | — | — |
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-0832898-A2 | Substituted amino acid derivatives | BAYER AG (DE) | 1998-04-01 | — | — | EP | disclosed |