Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 7/20 | 0.54 |
| ▸ | JAK2 | O60674 | 5/20 | 0.54 |
| ▸ | SYK | P43405 | 2/20 | 0.49 |
| ▸ | CDK2 | P24941 | 3/20 | 0.48 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.48 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.48 |
| ▸ | CDK9 | P50750 | 2/20 | 0.48 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.47 |
| ▸ | JAK1 | P23458 | 1/20 | 0.47 |
| ▸ | TYK2 | P29597 | 1/20 | 0.47 |
| ▸ | JAK3 | P52333 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | IGF1R | P08069 | 2/20 | 0.43 |
| ▸ | CDK1 | P06493 | 1/20 | 0.42 |
| ▸ | CDK4 | P11802 | 1/20 | 0.42 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.42 |
| ▸ | CCND1 | P24385 | 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 | |
|---|---|---|---|---|
| SCHEMBL1633643 | 0.91 | CDK4 (0.51) | TBK1JAK2SYKCDK2CCNE1 | |
| SCHEMBL1633182 | 0.90 | JAK2 (0.54) | TBK1JAK2SYKCDK2CCNE1 | |
| SCHEMBL1633613 | 0.87 | JAK2 (0.61) | TBK1JAK2SYKCDK2CCNE1 | |
| SCHEMBL1633537 | 0.86 | SYK (0.50) | TBK1JAK2SYKCDK2CCNE1 | |
| SCHEMBL1633103 | 0.86 | JAK2 (0.44) | TBK1JAK2SYKCDK2CCNT1 | |
| SCHEMBL1633150 | 0.85 | CDK4 (0.52) | TBK1JAK2SYKCDK2CCNE1 | |
| SCHEMBL1633288 | 0.84 | CDK4 (0.54) | TBK1JAK2CDK2CCNE1JAK1 | |
| SCHEMBL1633919 | 0.83 | JAK2 (0.50) | TBK1JAK2SYKJAK1TYK2 | |
| SCHEMBL13498236 | 0.82 | CDK4 (0.51) | TBK1JAK2SYKCDK2CCNE1 | |
| SCHEMBL13498315 | 0.82 | JAK2 (0.51) | TBK1JAK2CDK2CCNE1CCNT1 |
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 |