Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 15/20 | 0.68 |
| ▸ | AKT2 | P31751 | 10/20 | 0.68 |
| ▸ | AKT3 | Q9Y243 | 7/20 | 0.51 |
| ▸ | CCR5 | P51681 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | DRD4 | P21917 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5257804 | 0.91 | AKT1 (0.56) | AKT1AKT2AKT3CCR5DRD2 | |
| SCHEMBL5261966 | 0.83 | ALDH1A1 (0.59) | AKT1AKT2AKT3 | |
| SCHEMBL5310571 | 0.82 | AKT1 (0.70) | AKT1AKT2AKT3CCR5DRD2 | |
| SCHEMBL5312414 | 0.82 | AKT1 (0.70) | AKT1AKT2AKT3CCR5DRD2 | |
| SCHEMBL5330758 | 0.81 | AKT1 (1.00) | AKT1AKT2AKT3PAX8 | |
| SCHEMBL5363861 | 0.81 | AKT1 (1.00) | AKT1AKT2AKT3PAX8 | |
| SCHEMBL5257294 | 0.80 | AKT1 (0.64) | AKT1AKT2AKT3CCR5DRD2 | |
| SCHEMBL5313248 | 0.79 | AKT1 (0.74) | AKT1AKT2AKT3CCR5PAX8 | |
| SCHEMBL5259612 | 0.78 | AKT1 (0.61) | AKT1AKT2AKT3CCR5PAX8 | |
| SCHEMBL5256723 | 0.78 | AKT1 (0.61) | AKT1AKT2AKT3CCR5PAX8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1496896-A4 | INHIBITORS OF AKT ACTIVITY | MERCK & CO INC (US) | 2007-10-31 | — | — | EP | disclosed |
| EP-1496896-A1 | INHIBITORS OF AKT ACTIVITY | Merck & Co., Inc. (US) | 2005-01-19 | — | — | EP | disclosed |
| WO-2003086394-A1 | INHIBITORS OF AKT ACTIVITY | MERCK & CO., INC. (US) | 2003-10-23 | — | — | WO | disclosed |