Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 4/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.40 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | PLK1 | P53350 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28039144 | 1.00 | CNR2 (0.44) | CNR2CNR1ADRA1AADRA1BPDK1 | |
| SCHEMBL28823422 | 1.00 | CNR2 (0.44) | CNR2CNR1ADRA1AADRA1BPDK1 | |
| SCHEMBL28038888 | 1.00 | CNR2 (0.44) | CNR2CNR1ADRA1AADRA1BPDK1 | |
| SCHEMBL28038832 | 0.95 | ADRA1A (0.42) | CNR2CNR1ADRA1AADRA1BTSHR | |
| SCHEMBL31665348 | 0.87 | NAMPT (0.44) | ADRA1AADRA1BALDH1A1L3MBTL1KDM4E | |
| SCHEMBL31110129 | 0.87 | NAMPT (0.44) | ADRA1AADRA1BALDH1A1L3MBTL1KDM4E | |
| SCHEMBL23748672 | 0.85 | KDM4E (0.52) | CNR2CNR1ALDH1A1LMNAKDM4E | |
| SCHEMBL5136114 | 0.81 | PLK1 (0.51) | CNR2CNR1PLK1 | |
| SCHEMBL23748664 | 0.80 | CNR2 (0.50) | CNR2CNR1ALDH1A1KDM4EPLK1 | |
| SCHEMBL28038899 | 0.77 | ADRA1A (0.42) | ADRA1AADRA1BALDH1A1LMNAL3MBTL1 |
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-104981249-A | Antimicrobial compounds, their synthesis and applications thereof | SEC DEP FOR HEALTH | 2015-10-14 | — | — | CN | disclosed |