Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.51 |
| ▸ | NQO1 | P15559 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17861409 | 0.83 | CA12 (0.52) | CA12CA1CA9KCNA3NQO1 | |
| SCHEMBL13813783 | 0.81 | CYP1A2 (0.50) | CA12CA1CA9KCNA3NQO1 | |
| SCHEMBL13813784 | 0.80 | CA12 (0.52) | CA12CA1CA9KCNA3NQO1 | |
| SCHEMBL12986005 | 0.79 | KCNA3 (0.51) | CA12CA1CA9KCNA3NQO1 | |
| SCHEMBL13930276 | 0.79 | ALPL (0.56) | CA12CA1CA9KCNA3ALOX15 | |
| SCHEMBL13813789 | 0.77 | CA12 (0.47) | CA12CA1CA9KCNA3NQO1 | |
| SCHEMBL21377713 | 0.76 | CA12 (0.56) | CA12CA1CA9KCNA3NQO1 | |
| SCHEMBL13951917 | 0.74 | CA12 (0.44) | CA12CA1CA9KCNA3NQO1 | |
| SCHEMBL3918843 | 0.73 | MEN1 (0.49) | CA12CA1CA9KCNA3NQO1 | |
| SCHEMBL13813787 | 0.73 | CA12 (0.43) | CA12CA1CA9KCNA3NQO1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3233827-B1 | ANTIBACTERIAL COMPOUNDS HAVING BROAD SPECTRUM OF ACTIVITY | ACRAF (IT) | 2020-07-08 | — | — | EP | disclosed |