Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 6/20 | 0.56 |
| ▸ | CA1 | P00915 | 5/20 | 0.50 |
| ▸ | CA2 | P00918 | 5/20 | 0.50 |
| ▸ | CA9 | Q16790 | 4/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | RORC | P51449 | 1/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.49 |
| ▸ | CDK2 | P24941 | 2/20 | 0.48 |
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | JAK1 | P23458 | 1/20 | 0.47 |
| ▸ | TYK2 | P29597 | 1/20 | 0.47 |
| ▸ | JAK3 | P52333 | 1/20 | 0.47 |
| ▸ | STK4 | Q13043 | 2/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1633814 | 0.92 | EGFR (0.55) | IKBKBCA1CA2CA9CA12 | |
| SCHEMBL1634182 | 0.90 | CA1 (0.60) | IKBKBCA1CA2CA9CA12 | |
| SCHEMBL1632825 | 0.90 | IKBKB (0.48) | IKBKBCA1CA2CA9CA12 | |
| SCHEMBL1633821 | 0.88 | STK4 (0.52) | IKBKBCA1CA2CA9EGFR | |
| SCHEMBL1634190 | 0.87 | IKBKB (0.53) | IKBKBCA1CA2CA9CA12 | |
| SCHEMBL1633962 | 0.85 | IKBKB (0.51) | IKBKBCA1CA2CA9CA12 | |
| SCHEMBL1632432 | 0.82 | CYP1A2 (0.48) | IKBKBCA1CA2CA9CA12 | |
| SCHEMBL1634183 | 0.82 | EGFR (0.52) | IKBKBCA1CA2CA9CA12 | |
| SCHEMBL1633262 | 0.82 | IKBKB (0.49) | IKBKBCA1CA2CA9CA12 | |
| SCHEMBL1632814 | 0.81 | CDK2 (0.52) | IKBKBCA1CA2CA9CA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-7932262-B2 | Quinazolines for PDK1 inhibition | NOVARTIS AG (CH) | 2011-04-26 | — | — | US | disclosed |
| US-7932262-B2 | Quinazolines for PDK1 inhibition | NOVARTIS AG (CH) | 2011-04-26 | — | — | US | disclosed |
| US-7932262-B2 | Quinazolines for PDK1 inhibition | NOVARTIS AG (CH) | 2011-04-26 | — | — | US | disclosed |