Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CDK4 | P11802 | 13/20 | 0.34 |
| ▸ | CCND1 | P24385 | 13/20 | 0.34 |
| ▸ | CCND2 | P30279 | 13/20 | 0.34 |
| ▸ | CCND3 | P30281 | 13/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.31 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.31 |
| ▸ | SRC | P12931 | 1/20 | 0.31 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.31 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.31 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.31 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.31 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19212793 | 0.85 | MTNR1A (0.35) | PKMCDK4CCND1CCND2CCND3 | |
| SCHEMBL19211564 | 0.84 | MTNR1A (0.35) | CDK4CCND1CCND2CCND3KDM4E | |
| SCHEMBL19211571 | 0.77 | PKM (0.40) | PKMCDK4CCND1CCND2CCND3 | |
| SCHEMBL19212769 | 0.76 | CDK4 (0.33) | CDK4CCND1CCND2CCND3ADORA2A | |
| SCHEMBL20710551 | 0.76 | MAPK8 (0.46) | CDK4CCND1CCND2CCND3CCNB2 | |
| SCHEMBL19231467 | 0.75 | CDK4 (0.39) | PKMCDK4CCND1CCND2CCND3 | |
| SCHEMBL19211604 | 0.75 | MAPT (0.37) | PKMCDK4CCND1CCND2CCND3 | |
| SCHEMBL19212759 | 0.74 | CA1 (0.39) | PKMCDK4CCND1CCND2CCND3 | |
| SCHEMBL19211574 | 0.73 | CDK4 (0.44) | CDK4CCND1CCND2CCND3ALDH1A1 | |
| SCHEMBL18544236 | 0.71 | KCNH2 (0.40) | CDK4CCND1CCND2CCND3KCNH2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3413976-A1 | HETEROCYCLIC COMPOUNDS, IN PARTICULAR 2-OXO-4,4,5,5,6,6,7,7-OCTAHYDROBENZOXAZOLE DERIVATIVES, AND THEIR USE AS ANTIBACTERIAL COMPOUNDS | Redx Pharma PLC (GB) | 2018-12-19 | — | — | EP | disclosed |
| EP-3414246-A1 | ANTIBACTERIAL COMPOUNDS | Redx Pharma PLC (GB) | 2018-12-19 | — | — | EP | disclosed |
| WO-2017137743-A1 | ANTIBACTERIAL COMPOUNDS | REDX PHARMA PLC (GB) | 2017-08-17 | — | — | WO | disclosed |
| WO-2017137744-A1 | HETEROCYCLIC COMPOUNDS, IN PARTICULAR 2-OXO-4,4,5,5,6,6,7,7-OCTAHYDROBENZOXAZOLE DERIVATIVES, AND THEIR USE AS ANTIBACTERIAL COMPOUNDS | REDX PHARMA PLC (GB) | 2017-08-17 | — | — | WO | disclosed |