Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | INMT | O95050 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3078481 | 0.66 | — | — | |
| SCHEMBL14648466 | 0.62 | ACHE (0.42) | CA12CA1CA2CA9 | |
| SCHEMBL1662883 | 0.61 | — | — | |
| SCHEMBL17233960 | 0.61 | — | — | |
| Iodide SCHEMBL27502072 | 0.59 | — | — | |
| Hydrochloric Acid SCHEMBL1353327 | 0.59 | — | — | |
| SCHEMBL22167672 | 0.58 | — | — | |
| SCHEMBL7468780 | 0.58 | CA2 (0.57) | CA12CA1CA2CA9 | |
| SCHEMBL5062781 | 0.58 | — | — | |
| SCHEMBL1905622 | 0.56 | — | — |
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-2020135771-A1 | HETEROCYCLIC COMPOUND INTERMEDIATE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 武汉朗来科技发展有限公司 | 2020-07-02 | — | — | WO | disclosed |