Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MMP1 | P03956 | 4/20 | 0.36 |
| ▸ | PTGER2 | P43116 | 4/20 | 0.36 |
| ▸ | MMP3 | P08254 | 3/20 | 0.36 |
| ▸ | NAAA | Q02083 | 2/20 | 0.36 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.35 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.35 |
| ▸ | MMP7 | P09237 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
| ▸ | ECE1 | P42892 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27031032 | 0.85 | CYP2D6 (0.41) | CYP2D6MMP1PTGER2MMP7MMP12 | |
| SCHEMBL8899342 | 0.81 | CYP2D6 (0.46) | CYP2D6MMP1PTGER2MMP7MMP12 | |
| SCHEMBL11882612 | 0.77 | MMP1 (0.40) | MMP1NAAAMMP7MMP12ECE1 | |
| SCHEMBL11860786 | 0.74 | CYP1A2 (0.38) | CYP2D6PTGER2NAAAPTGER4PTGER3 | |
| SCHEMBL11400638 | 0.74 | CYP2D6 (0.40) | CYP2D6MMP1PTGER2PTGER4PTGER3 | |
| SCHEMBL913008 | 0.73 | CYP2D6 (0.39) | CYP2D6 | |
| SCHEMBL8941719 | 0.73 | CYP2D6 (0.52) | CYP2D6MMP1MMP3ALDH1A1 | |
| SCHEMBL1805933 | 0.72 | CYP2D6 (0.40) | CYP2D6ALDH1A1 | |
| SCHEMBL1767335 | 0.71 | CYP2D6 (0.37) | CYP2D6MMP1MMP7MMP12ECE1 | |
| SCHEMBL8032810 | 0.71 | CYP2D6 (0.37) | CYP2D6MMP1MMP7MMP12ECE1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109415293-B | Dehydrogenation reaction | 弗门尼舍有限公司 | 2022-08-02 | — | — | CN | claimed |
| CN-109415293-B | Dehydrogenation reaction | 弗门尼舍有限公司 | 2022-08-02 | — | — | CN | disclosed |
| CN-109415293-A | Dehydrogenation reaction | 弗门尼舍有限公司 | 2019-03-01 | — | — | CN | disclosed |