Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FADS1 | O60427 | 2/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
| ▸ | METTL3 | Q86U44 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL890483 | 0.89 | FADS1 (0.40) | FADS1GABRA1GABRB2METTL3TRPA1 | |
| SCHEMBL3959525 | 0.84 | HDAC1 (0.39) | FADS1GABRA1GABRB2CYP11B1CYP11B2 | |
| SCHEMBL890710 | 0.83 | FADS1 (0.40) | FADS1GABRA1GABRB2TRPA1AHR | |
| SCHEMBL890660 | 0.78 | GABRA1 (0.37) | FADS1GABRA1GABRB2METTL3TRPA1 | |
| SCHEMBL2715301 | 0.77 | MAPT (0.46) | KDM4ERXFP1GAAALDH1A1HPGD | |
| SCHEMBL890505 | 0.73 | PIK3CD (0.38) | FADS1GABRA1GABRB2CYP11B1CYP11B2 | |
| SCHEMBL23456485 | 0.72 | FADS1 (0.51) | FADS1GABRA1GABRB2AHRCYP11B1 | |
| SCHEMBL890482 | 0.72 | FADS1 (0.38) | FADS1GABRA1GABRB2TRPA1AHR | |
| SCHEMBL21772471 | 0.71 | SMN1; SMN2 (0.42) | FADS1GABRA1GABRB2KDM4ERXFP1 | |
| SCHEMBL21772792 | 0.71 | ALDH1A1 (0.41) | FADS1GABRB2METTL3KDM4EGAA |
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-2445898-A2 | 4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE DERIVATIVES AS PI3K INHIBITORS | Amgen, Inc (US) | 2012-05-02 | — | — | EP | disclosed |
| WO-2010151735-A2 | HETEROCYCLIC COMPOUNDS AND THEIR USES | AMGEN INC. (US) | 2010-12-29 | — | — | WO | disclosed |