Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 5/20 | 0.77 |
| ▸ | CDK2 | P24941 | 4/20 | 0.77 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.77 |
| ▸ | CDC42BPA | Q5VT25 | 2/20 | 0.77 |
| ▸ | CDK1 | P06493 | 2/20 | 0.77 |
| ▸ | SRPK1 | Q96SB4 | 2/20 | 0.77 |
| ▸ | SLK | Q9H2G2 | 3/20 | 0.51 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.51 |
| ▸ | FLT3 | P36888 | 2/20 | 0.51 |
| ▸ | MAP4K2 | Q12851 | 2/20 | 0.51 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.51 |
| ▸ | FES | P07332 | 1/20 | 0.51 |
| ▸ | FER | P16591 | 1/20 | 0.51 |
| ▸ | MARK3 | P27448 | 1/20 | 0.51 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.51 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.51 |
| ▸ | CHEK1 | O14757 | 11/20 | 0.48 |
| ▸ | KDR | P35968 | 3/20 | 0.46 |
| ▸ | GSK3A | P49840 | 2/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1290852 | 0.92 | IRAK4 (0.77) | IRAK4CDK2CDK5CDC42BPACDK1 | |
| SCHEMBL1290749 | 0.92 | IRAK4 (0.77) | IRAK4CDK2CDK5CDC42BPACDK1 | |
| SCHEMBL1290699 | 0.89 | IRAK4 (0.72) | IRAK4CDK2CDK5CDC42BPACDK1 | |
| SCHEMBL1291013 | 0.87 | IRAK4 (1.00) | IRAK4CDK2CDK5CDC42BPACDK1 | |
| SCHEMBL1291049 | 0.86 | IRAK4 (0.67) | IRAK4CDK2CDK5CDC42BPACDK1 | |
| SCHEMBL1291107 | 0.85 | IRAK4 (0.66) | IRAK4CDK2CDK5CDC42BPACDK1 | |
| SCHEMBL1290962 | 0.85 | IRAK4 (0.66) | IRAK4CDK2CDK5CDC42BPACDK1 | |
| SCHEMBL1290660 | 0.85 | IRAK4 (0.65) | IRAK4CDK2CDK5CDC42BPACDK1 | |
| SCHEMBL1290709 | 0.85 | IRAK4 (0.65) | IRAK4CDK2CDK5CDC42BPACDK1 | |
| SCHEMBL1290868 | 0.85 | IRAK4 (0.81) | IRAK4CDK2CDK5CDC42BPACDK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012045194-A1 | BENZODIAZEPINONES AS FAK INHIBITORS FOR TREATMENT OF CANCER | ABBOTT LABORATORIES (US) | 2012-04-12 | — | — | WO | disclosed |