Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 13/20 | 0.66 |
| ▸ | CA9 | Q16790 | 13/20 | 0.66 |
| ▸ | CA1 | P00915 | 9/20 | 0.66 |
| ▸ | CA4 | P22748 | 3/20 | 0.66 |
| ▸ | CA6 | P23280 | 3/20 | 0.66 |
| ▸ | CA7 | P43166 | 3/20 | 0.66 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.66 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.66 |
| ▸ | CA5A | P35218 | 2/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA3 | P07451 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL13038089 | 0.81 | CA9 (0.63) | CA12CA9CA1CA4CA6 | |
| Ethoxycoumarin SCHEMBL119072 | 0.79 | CA9 (1.00) | CA12CA9CA1CA4CA6 | |
| SCHEMBL8512831 | 0.79 | CA12 (1.00) | CA12CA9CA1CA4CYP1A2 | |
| SCHEMBL8515480 | 0.79 | CA12 (1.00) | CA12CA9CA1CA4CA6 | |
| SCHEMBL7315339 | 0.78 | MAOB (0.69) | CA12CA9CA1CA4CA6 | |
| SCHEMBL15745920 | 0.75 | CA12 (1.00) | CA12CA9CA1CA4CA6 | |
| SCHEMBL7309342 | 0.75 | CA12 (0.52) | CA12CA9CA1CA4CA6 | |
| SCHEMBL827318 | 0.75 | CA12 (0.60) | CA12CA9CA1CA4CA6 | |
| SCHEMBL29629327 | 0.74 | NQO1 (0.68) | CA12CA9CA1CA4CA6 | |
| SCHEMBL3825385 | 0.74 | NQO1 (0.68) | CA12CA9CA1CA4CA6 |
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-2012070024-A1 | CARBONIC ANHYDRASE INHIBITORS WITH ANTIMETASTATIC ACTIVITY | METASIGNAL THERAPEUTICS INC. (CA) | 2012-05-31 | — | — | WO | disclosed |