Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 6/20 | 0.63 |
| ▸ | MMP2 | P08253 | 2/20 | 0.44 |
| ▸ | MMP3 | P08254 | 2/20 | 0.44 |
| ▸ | MMP9 | P14780 | 2/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | PARL | Q9H300 | 2/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL9730386 | 0.89 | MMP13 (0.59) | MMP13MMP2MMP3MMP9AKR1C3 | |
| SCHEMBL10392048 | 0.83 | MMP13 (0.50) | MMP13MMP2MMP3MMP9AKR1C3 | |
| SCHEMBL9729935 | 0.81 | MMP13 (0.66) | MMP13MMP2MMP3MMP9MGLL | |
| SCHEMBL9730839 | 0.78 | MMP13 (0.52) | MMP13MMP2MMP3MMP9MGLL | |
| SCHEMBL10401778 | 0.78 | DDB1 (0.44) | MMP13MMP2MMP3MMP9ALDH1A1 | |
| SCHEMBL6724684 | 0.78 | MMP13 (1.00) | MMP13MMP2MMP3MMP9AKR1C3 | |
| SCHEMBL9736118 | 0.77 | CA12 (0.56) | MMP13MMP2MMP3MMP9ALDH1A1 | |
| SCHEMBL10465599 | 0.76 | MMP13 (0.47) | MMP13MMP2MMP3MMP9ALDH1A1 | |
| SCHEMBL9773395 | 0.74 | MMP13 (0.43) | MMP13MMP2MMP3MMP9ALDH1A1 | |
| SCHEMBL9738296 | 0.73 | NSD2 (0.46) | MMP13MMP2MMP3MMP9TSHR |
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-5093499-A | Spirodilactam derivatives | SHELL OIL COMPANY (US) | 1992-03-03 | — | — | US | disclosed |