Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 13/20 | 0.47 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.45 |
| ▸ | CDK2 | P24941 | 2/20 | 0.45 |
| ▸ | CDK9 | P50750 | 2/20 | 0.45 |
| ▸ | CDK4 | P11802 | 1/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.45 |
| ▸ | CCND1 | P24385 | 1/20 | 0.45 |
| ▸ | CCND3 | P30281 | 1/20 | 0.45 |
| ▸ | CDK7 | P50613 | 1/20 | 0.45 |
| ▸ | CCNH | P51946 | 1/20 | 0.45 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.45 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA4 | P22748 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.43 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1633494 | 0.89 | PIM1 (0.54) | IKBKBCA1CA2CA4CA9 | |
| SCHEMBL1632840 | 0.85 | IKBKB (0.48) | IKBKBCCNT1CDK2CDK9CDK4 | |
| SCHEMBL1633082 | 0.81 | IKBKB (0.45) | IKBKBCCNT1CDK2CDK9CDK4 | |
| SCHEMBL1632804 | 0.78 | NTRK1 (0.48) | IKBKBCCNT1CDK2CDK9CCNA2 | |
| SCHEMBL13498293 | 0.78 | IKBKB (0.41) | IKBKBCCNT1CDK2CDK9CDK4 | |
| SCHEMBL1632747 | 0.77 | CA1 (0.41) | IKBKBCCNT1CDK2CDK9CDK4 | |
| SCHEMBL1633663 | 0.77 | NTRK1 (0.47) | IKBKBCCNT1CDK2CDK9CCNA2 | |
| SCHEMBL1632659 | 0.76 | CA1 (0.47) | IKBKBCCNT1CDK2CDK9CA1 | |
| SCHEMBL1474734 | 0.76 | AURKA (0.52) | IKBKBCCNT1CDK2CDK9CDK4 | |
| SCHEMBL1632130 | 0.76 | SYK (0.47) | IKBKBCCNT1CDK2CDK9CDK7 |
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 |