Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACVR1 | Q04771 | 4/20 | 0.52 |
| ▸ | CDK9 | P50750 | 3/20 | 0.52 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.52 |
| ▸ | AURKA | O14965 | 1/20 | 0.52 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.52 |
| ▸ | ABL1 | P00519 | 1/20 | 0.52 |
| ▸ | LCK | P06239 | 1/20 | 0.52 |
| ▸ | MET | P08581 | 1/20 | 0.52 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.52 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.52 |
| ▸ | FLT1 | P17948 | 1/20 | 0.52 |
| ▸ | KDR | P35968 | 1/20 | 0.52 |
| ▸ | FLT3 | P36888 | 1/20 | 0.52 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.52 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.52 |
| ▸ | GSK3A | P49840 | 1/20 | 0.52 |
| ▸ | GSK3B | P49841 | 1/20 | 0.52 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.52 |
| ▸ | MST1R | Q04912 | 1/20 | 0.52 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL1632131 | 0.90 | BMPR2 (0.52) | CDK9AURKAMAP4K4ABL1LCK | |
| SCHEMBL1633395 | 0.89 | CDK2 (0.49) | ACVR1CDK9LRRK2KDRMAPK8 | |
| SCHEMBL1632814 | 0.81 | CDK2 (0.52) | CDK9KDRCCNT1CDK2CCNE1 | |
| SCHEMBL1632891 | 0.80 | JAK2 (0.48) | CDK9FGFR1FLT3CDK2CCNE1 | |
| SCHEMBL18376612 | 0.80 | RIPK2 (0.61) | ACVR1CDK9LRRK2AURKAMAP4K4 | |
| SCHEMBL1631342 | 0.80 | CDK2 (0.45) | CDK9LRRK2KDRCCNT1CDK2 | |
| SCHEMBL18376613 | 0.77 | JAK2 (0.59) | ACVR1CDK9LRRK2AURKAMAP4K4 | |
| SCHEMBL1632354 | 0.77 | PKM (0.43) | CDK9KDRCCNT1CDK2CCNE1 | |
| SCHEMBL1633421 | 0.76 | MAP3K5 (0.49) | ABL1PDGFRBCDK2CCNE1CDK1 | |
| SCHEMBL1634323 | 0.76 | JAK2 (0.47) | AURKALCKMAPK8AURKBCDK2 |
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 1 patent. 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 |