Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 10/20 | 0.51 |
| ▸ | FYN | P06241 | 5/20 | 0.43 |
| ▸ | STK17B | O94768 | 1/20 | 0.41 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.41 |
| ▸ | KIT | P10721 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.41 |
| ▸ | CDK7 | P50613 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.41 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.41 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.38 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL625399 | 0.95 | PIK3CA (0.53) | PIK3CAFYNKITPIM1FLT3 | |
| SCHEMBL626774 | 0.85 | PIK3CA (0.42) | PIK3CASTK17BSTK17ACYP3A4 | |
| SCHEMBL626144 | 0.83 | PIK3CA (0.57) | PIK3CAFYNKITPIM1FLT3 | |
| SCHEMBL626544 | 0.81 | ACKR3 (0.55) | PIK3CAFYN | |
| SCHEMBL626298 | 0.81 | PIK3CA (0.53) | PIK3CAFYNKITPIM1FLT3 | |
| SCHEMBL626268 | 0.81 | PIK3CA (0.59) | PIK3CAFYNKITPIM1FLT3 | |
| SCHEMBL624947 | 0.80 | FYN (0.51) | FYNSTK17BSTK17A | |
| SCHEMBL625400 | 0.80 | PIK3CA (0.43) | PIK3CACYP3A4PDE3BPDE3A | |
| SCHEMBL626893 | 0.79 | PIK3CA (0.49) | PIK3CAFYNHASPIN | |
| SCHEMBL626891 | 0.79 | PIK3CA (0.49) | PIK3CAFYNHASPIN |
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 |