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 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | FYN | P06241 | 7/20 | 0.41 |
| ▸ | F2RL3 | Q96RI0 | 4/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.40 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | ROS1 | P08922 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | PRKACA | P17612 | 1/20 | 0.38 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL625026 | 0.81 | FYN (0.64) | FYNPIK3CA | |
| SCHEMBL1945374 | 0.79 | FYN (0.64) | CA12CA1CA2CA9FYN | |
| SCHEMBL1945354 | 0.79 | FYN (0.51) | FYNF2RL3PIK3CG | |
| SCHEMBL625477 | 0.78 | FYN (0.50) | CA12CA1CA2CA9FYN | |
| SCHEMBL1945185 | 0.78 | FYN (0.58) | CA12CA1CA2CA9FYN | |
| SCHEMBL1945259 | 0.78 | FYN (0.67) | CA12CA1CA2CA9FYN | |
| SCHEMBL626625 | 0.78 | PIK3CA (0.43) | F2RL3PIK3CGPIK3CACYP3A4 | |
| SCHEMBL1945197 | 0.77 | FYN (0.66) | CA12CA1CA2CA9FYN | |
| SCHEMBL1945148 | 0.77 | FYN (0.66) | CA12CA1CA2CA9FYN | |
| SCHEMBL1944741 | 0.76 | FYN (0.47) | FYNF2RL3PIK3CGPIK3CA |
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-2012020215-A1 | AMINO- IMIDAZOLOTHIADIAZOLES FOR USE AS PROTEIN OR LIPID KINASE INHIBITORS | CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) | 2012-02-16 | — | — | WO | disclosed |