Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 11/20 | 0.62 |
| ▸ | MMP9 | P14780 | 11/20 | 0.62 |
| ▸ | MMP3 | P08254 | 4/20 | 0.62 |
| ▸ | MMP13 | P45452 | 6/20 | 0.53 |
| ▸ | MMP8 | P22894 | 4/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14783070 | 0.82 | MMP9 (0.66) | MMP2MMP9MMP3MMP13MMP8 | |
| SCHEMBL14782934 | 0.80 | MMP9 (0.59) | MMP2MMP9MMP3MMP13MMP8 | |
| SCHEMBL14782939 | 0.77 | MMP2 (0.72) | MMP2MMP9MMP3MMP13MMP8 | |
| SCHEMBL14788892 | 0.77 | MMP9 (0.72) | MMP2MMP9MMP3MMP13MMP8 | |
| SCHEMBL300824 | 0.76 | MMP2 (0.70) | MMP2MMP9MMP3MMP13MMP8 | |
| SCHEMBL300798 | 0.75 | MMP2 (0.69) | MMP2MMP9MMP3MMP13MMP8 | |
| SCHEMBL11143027 | 0.74 | MMP9 (0.68) | MMP2MMP9MMP3MMP13MMP8 | |
| SCHEMBL9011624 | 0.73 | TSHR (0.67) | EPHX2TDP1L3MBTL1HRH4HRH3 | |
| SCHEMBL9011734 | 0.73 | TSHR (0.67) | EPHX2TDP1L3MBTL1HRH4HRH3 | |
| SCHEMBL9011715 | 0.73 | TSHR (0.67) | EPHX2TDP1L3MBTL1HRH4HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013038153-A1 | 18F-LABELLED BARBITURATE COMPOUNDS FOR USE AS POSITRON EMISSION IMAGING AGENTS | THE UNIVERSITY COURT OF THE UNIVERSITY OF ABERDEEN (GB) | 2013-03-21 | — | — | WO | disclosed |