Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | KLK1 | P06870 | 2/20 | 0.34 |
| ▸ | F2 | P00734 | 4/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | PLAU | P00749 | 5/20 | 0.33 |
| ▸ | F9 | P00740 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.32 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 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 | |
|---|---|---|---|---|
| SCHEMBL1854564 | 0.79 | PRKCI (0.52) | CA12CA1CA2CA4CA6 | |
| SCHEMBL29659932 | 0.79 | PRKCI (0.52) | CA12CA1CA2CA4CA6 | |
| SCHEMBL4801156 | 0.72 | CDC25B (0.55) | CA12CA1CA2CA4CA6 | |
| SCHEMBL1629983 | 0.72 | PARP1 (0.50) | CA12CA1CA2CA4CA6 | |
| SCHEMBL8065481 | 0.72 | ALDH1A1 (0.50) | CA12CA1CA2CA9PRSS1 | |
| SCHEMBL16283148 | 0.71 | CA12 (0.42) | CA12CA1CA2CA4CA6 | |
| SCHEMBL20476529 | 0.71 | ALDH1A1 (0.44) | CA12CA1CA2CA4CA6 | |
| SCHEMBL61793 | 0.71 | MAPT (0.61) | CA12CA1CA2CA7CA9 | |
| SCHEMBL27733687 | 0.71 | SLC6A3 (0.49) | CA12CA1CA2CA4CA6 | |
| Hydrochloric Acid SCHEMBL11878214 | 0.69 | SLC6A3 (0.41) | CA12CA1CA2CA4CA6 |
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-2022081758-A1 | BICYCLIC COMPOUNDS | ALIGOS THERAPEUTICS, INC. (US) | 2022-04-21 | — | — | WO | disclosed |