Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL283318 | 0.83 | CNR2 (0.49) | CNR2NR1H2CTSSCTSKKMT2A | |
| SCHEMBL482800 | 0.78 | CNR2 (0.45) | CNR2CTSSCTSKKMT2AALDH1A1 | |
| SCHEMBL15017085 | 0.77 | CNR2 (0.38) | CNR2NR1H2CTSSCTSKKMT2A | |
| SCHEMBL13449911 | 0.76 | CNR2 (0.44) | CNR2CTSSCTSKKMT2AALDH1A1 | |
| SCHEMBL15669149 | 0.76 | CA14 (0.36) | CTSKKMT2AKDM4ENFKB1NFKB2 | |
| SCHEMBL24468317 | 0.75 | CNR2 (0.37) | CNR2NR1H2CTSSCTSKKMT2A | |
| SCHEMBL1782688 | 0.75 | ALOX5 (0.38) | CNR2NR1H2CTSSCTSKKMT2A | |
| SCHEMBL1950353 | 0.75 | HDAC6 (0.35) | CNR2CTSKKDM4ENFKB1NFKB2 | |
| Hydrochloric Acid SCHEMBL27875284 | 0.74 | CA14 (0.35) | KDM4ENFKB1NFKB2RELACA14 | |
| SCHEMBL24890720 | 0.74 | CNR2 (0.36) | CNR2NR1H2KMT2AALDH1A1ALOX5 |
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-2023125944-A1 | COMPOUND CONTAINING HETEROCYCLIC RING | 正大天晴药业集团股份有限公司 | 2023-07-06 | — | — | WO | disclosed |