Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 15/20 | 0.34 |
| ▸ | CA12 | O43570 | 14/20 | 0.34 |
| ▸ | CA1 | P00915 | 14/20 | 0.34 |
| ▸ | CA9 | Q16790 | 14/20 | 0.34 |
| ▸ | CDK2 | P24941 | 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 | |
|---|---|---|---|---|
| SCHEMBL8622818 | 0.93 | CA2 (0.38) | CA2CA12CA1CA9CDK2 | |
| SCHEMBL8617656 | 0.90 | CDK2 (0.38) | CA2CA12CA1CA9CDK2 | |
| SCHEMBL9037445 | 0.87 | CA12 (0.42) | CA2CA12CA1CA9 | |
| SCHEMBL9038291 | 0.83 | CA12 (0.41) | CA2CA12CA1CA9 | |
| SCHEMBL8623643 | 0.80 | CA12 (0.47) | CA2CA12CA1CA9 | |
| SCHEMBL8619753 | 0.79 | CA12 (0.50) | CA2CA12CA1CA9 | |
| SCHEMBL8619763 | 0.78 | CA2 (0.40) | CA2CA12CA1CA9CDK2 | |
| SCHEMBL8622828 | 0.77 | CDK2 (0.38) | CA2CA1CA9CDK2 | |
| SCHEMBL8620831 | 0.75 | CA12 (0.46) | CA2CA12CA1CA9 | |
| SCHEMBL8617666 | 0.74 | CDK2 (0.39) | CA2CA1CA9CDK2 |
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-0696289-A1 | BENZO F]QUINOXALINDIONE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN DRUGS | SCHERING AG (DE) | 1996-02-14 | — | — | EP | disclosed |