Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | MMP1 | P03956 | 4/20 | 0.46 |
| ▸ | MMP2 | P08253 | 4/20 | 0.46 |
| ▸ | MMP9 | P14780 | 4/20 | 0.46 |
| ▸ | MMP13 | P45452 | 4/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | EGFR | P00533 | 2/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
| ▸ | MMP3 | P08254 | 3/20 | 0.38 |
| ▸ | MMP7 | P09237 | 3/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL54207 | 0.85 | MMP9 (0.51) | MMP1MMP2MMP9MMP13CA1 | |
| SCHEMBL8281066 | 0.81 | MAPK1 (0.56) | HSP90AA1MMP1MMP2MMP9MMP13 | |
| SCHEMBL12078090 | 0.69 | HSP90AA1 (0.60) | HSP90AA1MMP1MMP2MMP9MMP13 | |
| SCHEMBL13505088 | 0.68 | MMP2 (0.64) | HSP90AA1MMP1MMP2MMP9MMP13 | |
| SCHEMBL3414517 | 0.68 | MMP2 (0.64) | HSP90AA1MMP1MMP2MMP9MMP13 | |
| SCHEMBL4385516 | 0.67 | MMP2 (0.59) | MMP1MMP2MMP9MMP13MMP8 | |
| SCHEMBL48808 | 0.67 | MMP2 (0.59) | MMP1MMP2MMP9MMP13MMP8 | |
| SCHEMBL54973 | 0.67 | MMP2 (0.59) | MMP1MMP2MMP9MMP13MMP8 | |
| SCHEMBL48807 | 0.67 | MMP2 (0.59) | MMP1MMP2MMP9MMP13MMP8 | |
| SCHEMBL1659340 | 0.67 | MAPK1 (0.83) | HSP90AA1MMP1MMP2MMP9MMP13 |
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-2005092844-A1 | NONPEPTIDE INHIBITORS OF MATRIX METALLOPROTEINASES | SOUTHERN RESEARCH INSTITUTE (US) | 2005-10-06 | — | — | WO | disclosed |