Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 19/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL538968 | 0.81 | AKT1 (0.41) | AKT1ESR1ESR2 | |
| SCHEMBL539070 | 0.80 | AKT1 (0.68) | AKT1 | |
| SCHEMBL868394 | 0.76 | AKT1 (0.62) | AKT1 | |
| SCHEMBL538833 | 0.75 | AKT1 (0.37) | AKT1 | |
| SCHEMBL868340 | 0.70 | AKT1 (0.54) | AKT1 | |
| SCHEMBL19926831 | 0.69 | CCNA2 (0.46) | — | |
| SCHEMBL10206989 | 0.68 | AKT1 (0.48) | AKT1 | |
| SCHEMBL868074 | 0.68 | AKT1 (0.48) | AKT1 | |
| SCHEMBL10167553 | 0.68 | AKT1 (0.48) | AKT1 | |
| SCHEMBL538567 | 0.67 | AKT1 (0.68) | AKT1 |
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-2413932-A1 | INHIBITORS OF AKT ACTIVITY | Merck Sharp & Dohme Corp. (US) | 2012-02-08 | — | — | EP | disclosed |
| WO-2010114780-A1 | INHIBITORS OF AKT ACTIVITY | MERCK SHARP & DOHME CORP. (US) | 2010-10-07 | — | — | WO | disclosed |