Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 4/20 | 0.44 |
| ▸ | CHUK | O15111 | 1/20 | 0.43 |
| ▸ | CDK1 | P06493 | 7/20 | 0.42 |
| ▸ | CDK2 | P24941 | 6/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.42 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.42 |
| ▸ | SYK | P43405 | 3/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 5/20 | 0.41 |
| ▸ | CDK7 | P50613 | 5/20 | 0.41 |
| ▸ | CDK9 | P50750 | 5/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.41 |
| ▸ | CCNH | P51946 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | STK4 | Q13043 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1633527 | 0.91 | IKBKB (0.51) | IKBKBCHUKCDK1CDK2CCNA2 | |
| SCHEMBL1632449 | 0.86 | CDK2 (0.42) | IKBKBCHUKCDK1CDK2CCNA2 | |
| SCHEMBL1632828 | 0.85 | IKBKB (0.48) | IKBKBCHUKCDK1CDK2SYK | |
| SCHEMBL1632515 | 0.80 | SYK (0.53) | IKBKBCHUKCDK1CDK2CCNA2 | |
| SCHEMBL1633423 | 0.79 | IKBKB (0.63) | IKBKBCDK1CDK2CCNA2CCNA1 | |
| SCHEMBL1633099 | 0.77 | IKBKB (0.65) | IKBKBCDK1CDK2CCNT1CDK7 | |
| SCHEMBL1571219 | 0.76 | IKBKB (0.48) | IKBKBCDK1CDK2SYKCCNT1 | |
| SCHEMBL1634724 | 0.74 | IKBKB (0.62) | IKBKBCDK1CDK2CCNA2CCNT1 | |
| SCHEMBL1633106 | 0.74 | IKBKB (0.49) | IKBKBCDK2CCNA2CCNA1CA1 | |
| SCHEMBL12724976 | 0.74 | CDK2 (0.43) | IKBKBCDK2SYKJAK2STK4 |
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 |