Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | MPO | P05164 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | RAF1 | P04049 | 7/20 | 0.41 |
| ▸ | BRAF | P15056 | 7/20 | 0.41 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.41 |
| ▸ | FDPS | P14324 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.39 |
| ▸ | KDM5A | P29375 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4000772 | 1.00 | KDM4E (0.50) | KDM4EMPOCYP3A4CYP1A2ADORA3 | |
| SCHEMBL14566838 | 0.85 | PLK1 (0.46) | RAF1BRAFPROKR1FDPSKDM5A | |
| SCHEMBL25820303 | 0.83 | FDPS (0.57) | CYP3A4ALDH1A1RAF1BRAFPROKR1 | |
| SCHEMBL23015656 | 0.81 | HPGD (0.48) | KDM4EADORA3ALDH1A1MAPTKDM5A | |
| SCHEMBL21212289 | 0.81 | GAA (0.46) | RAF1BRAFKMT2A | |
| SCHEMBL30418990 | 0.81 | KDM5C (0.44) | CYP3A4CYP1A2PROKR1KDM5A | |
| SCHEMBL6047032 | 0.81 | KDM5C (0.44) | CYP3A4CYP1A2PROKR1KDM5A | |
| SCHEMBL1759894 | 0.79 | KDM4C (0.55) | KDM4EALDH1A1PROKR1MAPTKDM5A | |
| SCHEMBL25905366 | 0.79 | PROKR1 (0.44) | KDM4ECYP3A4CYP1A2CYP2A6ALDH1A1 | |
| SCHEMBL8953772 | 0.78 | KDM4E (0.57) | KDM4ECYP3A4CYP1A2ALDH1A1PROKR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110234638-B | Heteroaryl phenoxy benzamide KAPPA opioid ligands | 辉瑞大药厂 | 2022-10-21 | — | — | CN | disclosed |