Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FYN | P06241 | 4/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.49 |
| ▸ | BRAF | P15056 | 5/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | RAD52 | P43351 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2882567 | 0.93 | RAD52 (0.47) | FYNBRAFALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL2882272 | 0.88 | FYN (0.48) | FYNALDH1A1HPGDSMN1; SMN2NPC1 | |
| SCHEMBL2319146 | 0.85 | FYN (0.51) | FYNADORA1ADORA3ADORA2BBRAF | |
| SCHEMBL2214323 | 0.84 | ALDH1A1 (0.41) | ADORA1ADORA3ADORA2BALDH1A1HPGD | |
| SCHEMBL2211969 | 0.84 | FYN (0.44) | FYNALDH1A1HPGDSMN1; SMN2RAB9A | |
| SCHEMBL2209412 | 0.82 | ABL1 (0.41) | ALDH1A1HPGDSMN1; SMN2HTTRAB9A | |
| SCHEMBL2209540 | 0.77 | BPTF (0.36) | ALDH1A1HPGDSMN1; SMN2HTTRAB9A | |
| SCHEMBL2880093 | 0.76 | RAD52 (0.48) | FYNBRAFALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL2881702 | 0.74 | KDM4E (0.45) | ADORA3ALDH1A1HPGDSMN1; SMN2NPC1 | |
| SCHEMBL2213858 | 0.72 | CDK2 (0.42) | ALDH1A1HPGDSMN1; SMN2NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1797096-B1 | PYRAZOLOPYRIMIDINES AS INHIBITORS OF PROTEIN KINASE B (AKT) | BAYER SCHERING PHARMA AG (DE) | 2011-07-27 | — | — | EP | disclosed |