Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL17822536 | 0.80 | — | — | |
| SCHEMBL9201455 | 0.80 | — | — | |
| SCHEMBL4695404 | 0.80 | — | — | |
| SCHEMBL27920507 | 0.75 | CA1 (0.46) | CA1CA9CYP1A2 | |
| SCHEMBL10899562 | 0.73 | — | — | |
| SCHEMBL12268 | 0.73 | — | — | |
| SCHEMBL12219 | 0.73 | — | — | |
| SCHEMBL12212 | 0.73 | — | — | |
| SCHEMBL14318336 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL1372279 | 0.71 | CA1 (0.43) | CA1CA9CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20050209355-A1 | [Novel Reactions and the Products of Such Reactions] | ROITMAN LIPA L | 2005-09-22 | — | — | US | disclosed |