Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 20/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.55 |
| ▸ | AKT2 | P31751 | 4/20 | 0.55 |
| ▸ | AKT3 | Q9Y243 | 4/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL14977088 | 0.95 | AKT1 (0.71) | AKT1CYP3A4CYP2D6CYP2C9AKT2 | |
| SCHEMBL14983580 | 0.91 | AKT1 (0.75) | AKT1CYP3A4CYP2D6CYP2C9AKT2 | |
| SCHEMBL14975701 | 0.90 | AKT1 (0.62) | AKT1CYP3A4CYP2D6CYP2C9AKT2 | |
| SCHEMBL14983701 | 0.87 | AKT1 (0.69) | AKT1CYP3A4CYP2D6CYP2C9AKT2 | |
| SCHEMBL14976398 | 0.87 | AKT1 (0.63) | AKT1CYP3A4CYP2D6CYP2C9AKT2 | |
| SCHEMBL14977103 | 0.85 | AKT1 (0.61) | AKT1CYP3A4CYP2D6CYP2C9AKT2 | |
| SCHEMBL14976178 | 0.85 | AKT1 (0.58) | AKT1CYP3A4CYP2D6CYP2C9AKT2 | |
| SCHEMBL14975618 | 0.85 | AKT1 (0.61) | AKT1CYP3A4CYP2D6CYP2C9AKT2 | |
| SCHEMBL14977057 | 0.85 | AKT1 (0.58) | AKT1CYP3A4CYP2D6CYP2C9AKT2 | |
| SCHEMBL14983586 | 0.85 | AKT1 (0.63) | AKT1CYP3A4CYP2D6CYP2C9AKT2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013078254-A1 | BICYCLIC HETEROARYL DERIVATIVES AS KINASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2013-05-30 | — | — | WO | claimed |
| WO-2013078254-A1 | BICYCLIC HETEROARYL DERIVATIVES AS KINASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2013-05-30 | — | — | WO | disclosed |
| WO-2013078254-A1 | BICYCLIC HETEROARYL DERIVATIVES AS KINASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2013-05-30 | — | — | WO | disclosed |