Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT2 | P31751 | 7/20 | 0.46 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.41 |
| ▸ | ENPP1 | P22413 | 3/20 | 0.41 |
| ▸ | FFAR2 | O15552 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL3918663 | 0.84 | AKT2 (0.62) | AKT2FFAR2GSK3BABCB1ABCC1 | |
| SCHEMBL3916263 | 0.79 | AKT2 (0.59) | AKT2ENPP1GSK3B | |
| SCHEMBL3919145 | 0.79 | AKT2 (0.46) | AKT2LRRK2FFAR2SMN1; SMN2GSK3B | |
| SCHEMBL3918670 | 0.77 | AKT2 (0.46) | AKT2LRRK2ENPP1FFAR2SMN1; SMN2 | |
| SCHEMBL4117984 | 0.77 | AKT2 (0.48) | AKT2LRRK2SMN1; SMN2GSK3BKDM4E | |
| SCHEMBL1002593 | 0.75 | AKT2 (0.57) | AKT2ENPP1FFAR2GSK3BLMNA | |
| SCHEMBL4124143 | 0.75 | STAT3 (0.55) | AKT2GSK3BKDM4EALDH1A1LMNA | |
| SCHEMBL1002065 | 0.74 | AKT2 (0.46) | AKT2FFAR2SMN1; SMN2ABCB1ABCC1 | |
| SCHEMBL3919082 | 0.73 | AKT2 (0.66) | AKT2GSK3B | |
| SCHEMBL1001627 | 0.71 | AKT2 (0.50) | AKT2SMN1; SMN2KDM4EALDH1A1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1812003-A1 | ORTHO- CONDENSED PYRIDINE AND PYRIMIDINE DERIVATIVES (E. G. PURINES) AS PROTEIN KINASES INHIBITORS | Astex Therapeutics Limited (GB) | 2007-08-01 | — | — | EP | disclosed |
| WO-2006046023-A1 | ORTHO- CONDENSED PYRIDINE AND PYRIMIDINE DERIVATIVES (E. G. PURINES) AS PROTEIN KINASES INHIBITORS | ASTEX THERAPEUTICS LIMITED (GB) | 2006-05-04 | — | — | WO | disclosed |