Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 15/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 15/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | EIF4E | P06730 | 7/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | ATR | Q13535 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16626057 | 0.91 | MKNK1 (0.55) | MKNK1MKNK2CYP3A4EIF4ECHEK1 | |
| SCHEMBL16621059 | 0.88 | CECR2 (0.47) | MKNK1MKNK2CYP3A4EIF4ECHEK1 | |
| SCHEMBL16620611 | 0.87 | MKNK1 (0.53) | MKNK1MKNK2CYP3A4EIF4ECHEK1 | |
| SCHEMBL16620577 | 0.83 | MKNK1 (0.42) | MKNK1MKNK2CYP3A4EIF4ECHEK1 | |
| SCHEMBL29756310 | 0.80 | CHEK1 (0.38) | MKNK1MKNK2CYP3A4EIF4ECHEK1 | |
| SCHEMBL24520016 | 0.77 | CHEK1 (0.42) | CHEK1PIK3CAATR | |
| SCHEMBL17969583 | 0.76 | MET (0.41) | CHEK1PIK3CAATRJAK2CDK9 | |
| SCHEMBL16625991 | 0.76 | MKNK1 (0.52) | MKNK1MKNK2CYP3A4EIF4EPIK3CA | |
| SCHEMBL24520103 | 0.76 | CHEK1 (0.41) | CHEK1PIK3CAATRJAK2CDK9 | |
| SCHEMBL16625805 | 0.76 | MKNK1 (0.53) | MKNK1MKNK2CYP3A4EIF4EKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3052501-B1 | BICYCLIC ALKYNE DERIVATIVES AND USES THEREOF | AGENCY SCIENCE TECH & RES (SG) | 2022-06-22 | — | — | EP | disclosed |