Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | EP300 | Q09472 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18572160 | 0.78 | CA12 (0.38) | CA12CA1CA2CA9 | |
| SCHEMBL26056445 | 0.78 | — | — | |
| SCHEMBL20937448 | 0.75 | CA12 (0.36) | CA12CA1CA2CA9 | |
| SCHEMBL23136584 | 0.72 | CA12 (0.34) | CA12CA1CA2CA9 | |
| SCHEMBL22679765 | 0.72 | CA12 (0.34) | CA12CA1CA2CA9 | |
| SCHEMBL18572159 | 0.67 | CA12 (0.35) | CA12CA1CA2CA9 | |
| SCHEMBL3261185 | 0.67 | — | — | |
| SCHEMBL22679955 | 0.62 | — | — | |
| SCHEMBL22679766 | 0.62 | — | — | |
| SCHEMBL1648797 | 0.62 | CA12 (0.42) | CA12CA1CA2CA9CYP3A4 |
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-2019118313-A1 | IMIDAZO [1,2-C] QUINAZOLIN-5-AMINE COMPOUNDS WITH A2A ANTAGONIST PROPERTIES | MERCK SHARP & DOHME CORP. (US) | 2019-06-20 | — | — | WO | disclosed |