Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | FAAH | O00519 | 8/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.41 |
| ▸ | TP53 | P04637 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TBK1 | Q9UHD2 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16664929 | 0.83 | NPC1 (0.51) | EGFRFAAHCYP1A2CYP3A4HSD17B10 | |
| SCHEMBL15356477 | 0.77 | KIT (0.50) | EGFRFAAHCYP1A2CYP3A4HSD17B10 | |
| SCHEMBL27700679 | 0.77 | TRPV1 (0.44) | FAAHCYP1A2CYP3A4HSD17B10TP53 | |
| SCHEMBL15343164 | 0.77 | SYK (0.43) | EGFRFAAHCYP1A2CYP3A4HSD17B10 | |
| SCHEMBL11786092 | 0.76 | CYP1A2 (0.56) | FAAHCYP1A2CYP3A4HSD17B10TP53 | |
| SCHEMBL15343278 | 0.75 | FAAH (0.50) | EGFRFAAHCYP1A2CYP3A4HSD17B10 | |
| SCHEMBL15343345 | 0.75 | CYP1A2 (0.53) | FAAHCYP1A2CYP3A4HSD17B10TP53 | |
| SCHEMBL15343152 | 0.74 | SYK (0.41) | EGFRFAAHCYP1A2CYP3A4HSD17B10 | |
| SCHEMBL15343155 | 0.73 | CLK4 (0.40) | EGFRFAAHCYP1A2CYP3A4HSD17B10 | |
| SCHEMBL15343181 | 0.73 | KARS1 (0.51) | EGFRFAAHMAPK1MAPTTBK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015058031-A1 | DNA-PK INHIBITORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2015-04-23 | — | — | WO | disclosed |