Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 4/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.46 |
| ▸ | SYK | P43405 | 3/20 | 0.45 |
| ▸ | IKBKB | O14920 | 4/20 | 0.44 |
| ▸ | CDK1 | P06493 | 3/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 2/20 | 0.43 |
| ▸ | CDC7 | O00311 | 1/20 | 0.43 |
| ▸ | PLK4 | O00444 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.43 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1634182 | 0.86 | CA1 (0.60) | CA1CA2CA9CDK2IKBKB | |
| SCHEMBL1633814 | 0.85 | EGFR (0.55) | CA1CA2CA9CDK2CCNA2 | |
| SCHEMBL1633419 | 0.85 | NTRK1 (0.44) | CA1CA2CA9CDK2CCNA2 | |
| SCHEMBL1633262 | 0.82 | IKBKB (0.49) | CA1CA2CA9CDK2CCNA2 | |
| SCHEMBL1633411 | 0.81 | MTOR (0.50) | CA1CA2CA9CDK2CCNA2 | |
| SCHEMBL1633446 | 0.81 | IKBKB (0.56) | CA1CA2CA9CDK2IKBKB | |
| SCHEMBL1634688 | 0.81 | RXFP1 (0.45) | CA1CA2CA9CDK2SYK | |
| SCHEMBL1634190 | 0.80 | IKBKB (0.53) | CA1CA2CA9CDK2CCNA2 | |
| SCHEMBL1632432 | 0.80 | CYP1A2 (0.48) | CA1CA2CA9CDK2CCNA2 | |
| SCHEMBL1633821 | 0.80 | STK4 (0.52) | CA1CA2CA9CDK2IKBKB |
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 |