Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31341717 | 0.85 | HDAC1 (0.31) | CA12CA1CA14CA2HDAC6 | |
| SCHEMBL29029290 | 0.79 | GABRR1 (0.33) | CA12CA1CA14CA2HDAC6 | |
| SCHEMBL6687835 | 0.74 | HDAC6 (0.39) | CA12CA1CA14CA2HDAC6 | |
| SCHEMBL6285478 | 0.73 | HDAC6 (0.34) | CA12CA1CA14CA2HDAC6 | |
| SCHEMBL6276163 | 0.72 | CA14 (0.36) | CA12CA1CA14CA2HDAC6 | |
| SCHEMBL15346140 | 0.72 | HDAC6 (0.32) | HDAC6HDAC1HDAC2 | |
| SCHEMBL31261031 | 0.72 | HDAC6 (0.33) | HDAC6HDAC1HDAC2 | |
| SCHEMBL5402224 | 0.72 | MAPK1 (0.37) | CA12CA1CA14CA2HDAC6 | |
| SCHEMBL6285387 | 0.71 | HDAC6 (0.33) | CA12CA1CA14CA2HDAC6 | |
| SCHEMBL3423361 | 0.71 | CA14 (0.38) | CA12CA1CA14CA2HDAC6 |
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-1084110-A1 | QUINOLONES USED AS MRS INHIBITORS AND BACTERICIDES | SMITHKLINE BEECHAM PLC (GB) | 2001-03-21 | — | — | EP | disclosed |
| WO-1999055677-A1 | QUINOLONES USED AS MRS INHIBITORS AND BACTERICIDES | SMITHKLINE BEECHAM PLC (GB) | 1999-11-04 | — | — | WO | disclosed |