Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 3/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL8015521 | 1.00 | MEN1 (0.32) | MEN1ALDH1A1KMT2ABCHEEPHX1 | |
| SCHEMBL20751876 | 0.85 | BCHE (0.33) | ALDH1A1BCHE | |
| SCHEMBL8222151 | 0.75 | MEN1 (0.36) | MEN1ALDH1A1KMT2A | |
| SCHEMBL733235 | 0.75 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL8205066 | 0.75 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL733236 | 0.75 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL3497714 | 0.75 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL3495039 | 0.75 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL731017 | 0.74 | CNR2 (0.31) | — | |
| SCHEMBL3493952 | 0.74 | ALDH1A1 (0.33) | MEN1ALDH1A1KMT2A |
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-2009134624-A1 | HCV NS3 PROTEASE INHIBITORS | MERCK & CO., INC. (US) | 2009-11-05 | — | — | WO | disclosed |