Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 7/20 | 0.45 |
| ▸ | CA9 | Q16790 | 7/20 | 0.45 |
| ▸ | CA1 | P00915 | 6/20 | 0.45 |
| ▸ | CA2 | P00918 | 5/20 | 0.45 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.39 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.37 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11766200 | 0.93 | CA12 (0.43) | CA12CA9CA1CA2MGLL | |
| SCHEMBL20686882 | 0.87 | CA12 (0.46) | CA12CA9CA1CA2MGLL | |
| SCHEMBL8073515 | 0.87 | CA12 (0.46) | CA12CA9CA1CA2ALDH1A1 | |
| SCHEMBL19228775 | 0.86 | MGLL (0.50) | CA12CA9CA1CA2MGLL | |
| SCHEMBL28196615 | 0.85 | CA12 (0.44) | CA12CA9CA1CA2MGLL | |
| SCHEMBL21610454 | 0.81 | TSHR (0.45) | CA12CA9CA1CA2MGLL | |
| SCHEMBL375966 | 0.79 | CA12 (0.41) | CA12CA9CA1CA2MGLL | |
| SCHEMBL18948960 | 0.78 | CA12 (0.50) | CA12CA9CA1CA2MGLL | |
| SCHEMBL10659482 | 0.77 | CA12 (0.50) | CA12CA9CA1CA2MGLL | |
| SCHEMBL430880 | 0.77 | TSHR (0.43) | CA12CA9CA1CA2MGLL |
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-2023158789-A1 | ORAL FORMULATIONS OF FASUDIL WITH ION EXCHANGE RESIN | WOOLSEY PHARMACEUTICALS, INC. (US) | 2023-08-24 | — | — | WO | disclosed |