Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 3/20 | 0.49 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.47 |
| ▸ | CDK1 | P06493 | 3/20 | 0.47 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.47 |
| ▸ | CDK9 | P50750 | 3/20 | 0.47 |
| ▸ | PTK2 | Q05397 | 3/20 | 0.46 |
| ▸ | CDK7 | P50613 | 2/20 | 0.44 |
| ▸ | CCNH | P51946 | 2/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | IKBKB | O14920 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL1633586 | 0.91 | CA1 (0.51) | NTRK1CA2CCNT1CDK1CCNB1 | |
| SCHEMBL13498245 | 0.84 | CDK2 (0.48) | NTRK1CA2CCNT1CDK1CCNB1 | |
| SCHEMBL1632328 | 0.79 | CA2 (0.50) | NTRK1CA2CCNT1CDK1CCNB1 | |
| SCHEMBL1633146 | 0.79 | CA1 (0.49) | NTRK1CA2CCNT1CDK1CCNB1 | |
| SCHEMBL1633321 | 0.78 | CA1 (0.48) | NTRK1CA2CCNT1CDK1CCNB1 | |
| SCHEMBL1632468 | 0.77 | MEN1 (0.55) | CA2CCNT1CDK1CCNB1CDK9 | |
| SCHEMBL1634272 | 0.77 | CA2 (0.49) | CA2CCNT1CDK1CCNB1CDK9 | |
| SCHEMBL1633835 | 0.76 | IKBKB (0.47) | NTRK1CA2CCNT1CDK1CCNB1 | |
| SCHEMBL1633856 | 0.76 | PTK2 (0.48) | NTRK1CA2CCNT1CDK1CCNB1 | |
| SCHEMBL1634500 | 0.76 | SYK (0.49) | NTRK1CA2CCNT1CDK1CCNB1 |
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 |