Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CACNA1B | Q00975 | 3/20 | 0.41 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.41 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 2/20 | 0.37 |
| ▸ | MMP13 | P45452 | 2/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL8855056 | 0.87 | CA1 (0.46) | CA1CA2CA9CACNA1BCACNA1H | |
| SCHEMBL10941027 | 0.87 | CA1 (0.41) | CA1CA2CA9CACNA1BCACNA1H | |
| SCHEMBL9778980 | 0.86 | CA1 (0.45) | CA1CA2CA9CACNA1BCACNA1H | |
| SCHEMBL6820329 | 0.84 | CA1 (0.51) | CA1CA2CA9CACNA1BCACNA1H | |
| SCHEMBL926865 | 0.83 | CA12 (0.49) | CA1CA2CA9SLC6A2SLC6A4 | |
| SCHEMBL997994 | 0.81 | CASP1 (0.48) | CA1CA2CA9KMT2APGR | |
| SCHEMBL30307015 | 0.80 | TRPV4 (0.46) | KMT2ASLC6A2SLC6A4SLC6A3PTGES2 | |
| SCHEMBL7386055 | 0.80 | TRPV4 (0.46) | KMT2ASLC6A2SLC6A4SLC6A3PTGES2 | |
| SCHEMBL9778885 | 0.80 | NR3C1 (0.45) | CA1CA2CA9CACNA1BCACNA1H | |
| SCHEMBL10941024 | 0.80 | LMNA (0.45) | EPAS1KMT2AMCL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2089365-A1 | HETEROCYCLIC DERIVED METALLOPROTEASE INHIBITORS | Janssen Pharmaceutica, N.V. (BE) | 2009-08-19 | — | — | EP | disclosed |
| WO-2008045668-A1 | HETEROCYCLIC DERIVED METALLOPROTEASE INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-04-17 | — | — | WO | disclosed |