Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.38 |
| ▸ | CA9 | Q16790 | 4/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13735437 | 0.90 | CA12 (0.44) | CA12CA9CA1CA2 | |
| SCHEMBL28451994 | 0.87 | CA12 (0.33) | CA12CA9CA1CA2 | |
| SCHEMBL8512235 | 0.79 | CA12 (0.42) | CA12CA9CA1CA2 | |
| SCHEMBL8512237 | 0.79 | CA12 (0.42) | CA12CA9CA1CA2 | |
| SCHEMBL18555563 | 0.79 | CA12 (0.42) | CA12CA9CA1CA2 | |
| SCHEMBL30873268 | 0.79 | CA12 (0.42) | CA12CA9CA1CA2 | |
| SCHEMBL24268407 | 0.72 | CA12 (0.39) | CA12CA9CA1CA2 | |
| SCHEMBL7679245 | 0.70 | CA12 (0.35) | CA12CA9CA1CA2 | |
| SCHEMBL14440425 | 0.70 | CA12 (0.35) | CA12CA9CA1CA2 | |
| SCHEMBL7659117 | 0.70 | CA12 (0.35) | CA12CA9CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111499580-A | Substituted diaminocarboxamides and diaminocarbonitrile pyrimidines, compositions thereof, and methods of treatment therewith | 西格诺药品有限公司 | 2020-08-07 | — | — | CN | disclosed |