Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 13/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 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 | |
|---|---|---|---|---|
| SCHEMBL12683101 | 0.92 | AAK1 (0.35) | AAK1MEN1KMT2AEGFRBACE1 | |
| SCHEMBL15372106 | 0.89 | AAK1 (0.33) | AAK1DGAT1 | |
| SCHEMBL15372108 | 0.81 | AAK1 (0.32) | AAK1MEN1KMT2A | |
| SCHEMBL12682967 | 0.77 | ALDH1A1 (0.36) | AAK1MEN1KMT2AEGFR | |
| SCHEMBL12683057 | 0.73 | USP30 (0.32) | — | |
| SCHEMBL15372105 | 0.71 | ALDH1A1 (0.35) | AAK1MEN1KMT2A | |
| SCHEMBL12682980 | 0.69 | ALDH1A1 (0.36) | AAK1MEN1KMT2AEGFR | |
| SCHEMBL10170835 | 0.66 | SSTR3 (0.46) | AAK1KMT2A | |
| SCHEMBL13294212 | 0.65 | SSTR3 (0.48) | AAK1MEN1KMT2A | |
| SCHEMBL8752781 | 0.65 | SSTR3 (0.48) | AAK1MEN1KMT2A |
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-2012050918-A2 | TRICYCLIC FUSED RING INHIBITORS OF HEPATITIS C | PRESIDIO PHARMACEUTICAL, INC. (US) | 2012-04-19 | — | — | WO | disclosed |