Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | UBE2N | P61088 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | TNK2 | Q07912 | 2/20 | 0.54 |
| ▸ | EGFR | P00533 | 2/20 | 0.50 |
| ▸ | KDR | P35968 | 2/20 | 0.49 |
| ▸ | TEK | Q02763 | 2/20 | 0.49 |
| ▸ | AURKA | O14965 | 6/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.46 |
| ▸ | RAD52 | P43351 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2966671 | 0.92 | ALDH1A1 (0.64) | ALDH1A1HPGDKDM4EUBE2NSMN1; SMN2 | |
| SCHEMBL1901095 | 0.78 | ALDH1A1 (0.55) | ALDH1A1HPGDKDM4EUBE2NSMN1; SMN2 | |
| SCHEMBL4697230 | 0.75 | KDM4E (0.67) | ALDH1A1HPGDKDM4EUBE2NSMN1; SMN2 | |
| SCHEMBL4530280 | 0.75 | KDM4E (0.67) | ALDH1A1HPGDKDM4EUBE2NSMN1; SMN2 | |
| SCHEMBL4531398 | 0.75 | KDM4E (0.63) | ALDH1A1HPGDKDM4EUBE2NSMN1; SMN2 | |
| SCHEMBL6749029 | 0.75 | KDM4E (0.63) | ALDH1A1HPGDKDM4EUBE2NSMN1; SMN2 | |
| SCHEMBL4535869 | 0.74 | KDM4E (0.59) | ALDH1A1HPGDKDM4EUBE2NSMN1; SMN2 | |
| SCHEMBL1904398 | 0.74 | EGFR (0.49) | ALDH1A1HPGDKDM4EUBE2NSMN1; SMN2 | |
| SCHEMBL6748878 | 0.74 | KDM4E (0.58) | ALDH1A1HPGDKDM4EUBE2NSMN1; SMN2 | |
| SCHEMBL13271835 | 0.74 | TNK2 (0.68) | ALDH1A1HPGDKDM4EUBE2NSMN1; SMN2 |
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-2496566-A1 | AKT / PKB INHIBITORS | Almac Discovery Limited (GB) | 2012-09-12 | — | — | EP | disclosed |
| WO-2011055115-A1 | AKT / PKB INHIBITORS | ALMAC DISCOVERY LIMITED (GB) | 2011-05-12 | — | — | WO | disclosed |