Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 1/20 | 0.44 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.44 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.38 |
| ▸ | MTOR | P42345 | 2/20 | 0.38 |
| ▸ | RICTOR | Q6R327 | 2/20 | 0.38 |
| ▸ | RPTOR | Q8N122 | 2/20 | 0.38 |
| ▸ | MAPKAP1 | Q9BPZ7 | 2/20 | 0.38 |
| ▸ | MLST8 | Q9BVC4 | 2/20 | 0.38 |
| ▸ | PDE9A | O76083 | 12/20 | 0.37 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.36 |
| ▸ | PI4KA | P42356 | 1/20 | 0.36 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.36 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.36 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.36 |
| ▸ | SLC2A1 | P11166 | 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 | |
|---|---|---|---|---|
| SCHEMBL21459294 | 1.00 | CDK1 (0.44) | CDK1CCNB1CCNE1CDK2KDM4E | |
| SCHEMBL24500614 | 0.84 | KDM4E (0.42) | KDM4EKMT2APDE9APDE1CPI4KA | |
| SCHEMBL31403622 | 0.83 | ADORA2A (0.46) | KDM4EKMT2APDE9APDE1C | |
| SCHEMBL24500179 | 0.83 | KDM4E (0.41) | CDK1KDM4EKMT2APDE9APDE1C | |
| SCHEMBL31403538 | 0.83 | KDM4E (0.41) | CDK1CCNB1CCNE1CDK2KDM4E | |
| SCHEMBL30096023 | 0.82 | MTOR (0.41) | CDK1CCNB1CCNE1CDK2KDM4E | |
| SCHEMBL30382424 | 0.80 | KDM4E (0.40) | CDK1KDM4EKMT2APDE9APDE1C | |
| Hydrochloric Acid SCHEMBL29389071 | 0.79 | KDM4E (0.39) | KDM4EKMT2APDE9APDE1C | |
| SCHEMBL130702 | 0.76 | PI4KA (0.56) | CDK1CCNB1CCNE1CDK2KDM4E | |
| SCHEMBL12206789 | 0.75 | PI4KB (0.61) | KDM4EKMT2APIK3CAMTORPI4KA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3312182-B9 | BRK INHIBITORY COMPOUND | ONO PHARMACEUTICAL CO (JP) | 2022-06-29 | — | — | EP | claimed |
| EP-3312182-B1 | BRK INHIBITORY COMPOUND | ONO PHARMACEUTICAL CO (JP) | 2022-02-23 | — | — | EP | claimed |