Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 10/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 1/20 | 0.35 |
| ▸ | NT5E | P21589 | 2/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL357452 | 0.80 | PIK3CD (0.61) | PIK3CDHDAC1TNFNT5ESMN1; SMN2 | |
| SCHEMBL362572 | 0.80 | PIK3CD (0.42) | PIK3CDHDAC1TNFNT5EHRH3 | |
| SCHEMBL370831 | 0.80 | PIK3CD (0.60) | PIK3CDPIK3CA | |
| SCHEMBL18032516 | 0.79 | TNF (0.42) | PIK3CDHDAC1TNFNT5EHRH3 | |
| SCHEMBL369833 | 0.78 | PIK3CD (0.75) | PIK3CDPIK3CA | |
| SCHEMBL371276 | 0.78 | PIK3CD (0.49) | PIK3CDTNFCYP3A4PIK3CA | |
| SCHEMBL18032512 | 0.77 | HDAC1 (0.42) | PIK3CDHDAC1TNFNT5EHRH3 | |
| SCHEMBL18032511 | 0.76 | PIK3CD (0.52) | PIK3CDHDAC1TNFNT5EHRH3 | |
| SCHEMBL18032506 | 0.76 | TNF (0.41) | PIK3CDHDAC1TNFNT5EHRH3 | |
| SCHEMBL358553 | 0.75 | PIK3CD (0.46) | PIK3CDHDAC1TNFSMN1; SMN2PIK3CA |
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-2593455-A1 | PURINE COMPOUNDS SELECTIVE FOR I3 P110 DELTA, AND METHODS OF USE | F.HOFFMANN-LA ROCHE AG (CH) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012007493-A1 | PURINE COMPOUNDS SELECTIVE FOR ΡI3Κ P110 DELTA, AND METHODS OF USE | F. HOFFMANN-LA ROCHE AG (CH) | 2012-01-19 | — | — | WO | disclosed |