Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.39 |
| ▸ | AKT3 | Q9Y243 | 8/20 | 0.38 |
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | KIT | P10721 | 1/20 | 0.37 |
| ▸ | PRKCA | P17252 | 1/20 | 0.37 |
| ▸ | PRKACA | P17612 | 1/20 | 0.37 |
| ▸ | PRKACG | P22612 | 1/20 | 0.37 |
| ▸ | PRKACB | P22694 | 1/20 | 0.37 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.37 |
| ▸ | AKT1 | P31749 | 1/20 | 0.37 |
| ▸ | AKT2 | P31751 | 1/20 | 0.37 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4562968 | 1.00 | ALDH1A1 (0.41) | ALDH1A1LMNAHDAC8AKT3MET | |
| SCHEMBL4378945 | 0.87 | ALDH1A1 (0.44) | ALDH1A1LMNA | |
| SCHEMBL4374524 | 0.81 | ALDH1A1 (0.47) | ALDH1A1LMNA | |
| SCHEMBL4583485 | 0.81 | ALDH1A1 (0.47) | ALDH1A1LMNA | |
| SCHEMBL4375391 | 0.81 | ALDH1A1 (0.42) | ALDH1A1LMNAAKT3AKT1AKT2 | |
| SCHEMBL4380618 | 0.80 | ALDH1A1 (0.41) | ALDH1A1LMNAAKT3AKT1AKT2 | |
| SCHEMBL4373508 | 0.79 | ALDH1A1 (0.42) | ALDH1A1LMNAAKT3PRKCAPRKACA | |
| SCHEMBL4376938 | 0.79 | ALDH1A1 (0.44) | ALDH1A1LMNAAKT3AKT1AKT2 | |
| SCHEMBL4373196 | 0.78 | ALDH1A1 (0.45) | ALDH1A1LMNA | |
| SCHEMBL1529597 | 0.77 | AKT3 (0.44) | ALDH1A1LMNAHDAC8AKT3MET |
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-2117523-A1 | INHIBITORS OF AKT ACTIVITY | SmithKline Beecham Corporation (US) | 2009-11-18 | — | — | EP | disclosed |
| WO-2008098104-A1 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2008-08-14 | — | — | WO | disclosed |