Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | AKT1 | P31749 | 1/20 | 0.31 |
| ▸ | IRAK4 | Q9NWZ3 | 6/20 | 0.30 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.30 |
| ▸ | BTK | Q06187 | 2/20 | 0.30 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL626888 | 0.89 | AAK1 (0.34) | AAK1AKT1JAK2JAK1 | |
| SCHEMBL17764699 | 0.70 | AAK1 (0.37) | AAK1CDK2AKT1BTK | |
| SCHEMBL625036 | 0.69 | PIM1 (0.49) | — | |
| SCHEMBL625189 | 0.69 | PIK3CA (0.46) | — | |
| SCHEMBL17764670 | 0.69 | AXL (0.42) | AAK1CDK2IRAK4CHEK1 | |
| SCHEMBL627106 | 0.69 | FYN (0.44) | BTKJAK2JAK1 | |
| SCHEMBL626398 | 0.69 | FYN (0.44) | BTKJAK2JAK1 | |
| SCHEMBL15719996 | 0.69 | PDE2A (0.42) | — | |
| SCHEMBL3955485 | 0.68 | CPN1 (0.39) | AAK1BTK | |
| SCHEMBL627225 | 0.68 | CKS1B (0.48) | BTK |
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 |