Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.43 |
| ▸ | HTR1D | P28221 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | F2 | P00734 | 2/20 | 0.39 |
| ▸ | F10 | P00742 | 2/20 | 0.39 |
| ▸ | F7 | P08709 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.36 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14369641 | 0.80 | OPRM1 (0.39) | HTR1AHTR1DHTR2CF2F10 | |
| SCHEMBL4965627 | 0.78 | OPRM1 (0.50) | HTR1AHTR1DHTR2CNPSR1OPRM1 | |
| Trifluoroacetic Acid SCHEMBL4967345 | 0.74 | TRPM8 (0.37) | HTR1AHTR1DHTR2CF2F10 | |
| SCHEMBL1346996 | 0.74 | TRPV1 (0.49) | RORC | |
| SCHEMBL3691407 | 0.71 | LPAR1 (0.53) | BCHEACHEOPRM1SLC6A2SLC6A4 | |
| SCHEMBL14369647 | 0.70 | HIF1A (0.33) | F2F10F7BCHEACHE | |
| SCHEMBL14369648 | 0.70 | F2 (0.34) | F2F10F7OPRM1TSHR | |
| SCHEMBL4984818 | 0.70 | MRGPRX4 (0.49) | KDM4EALDH1A1LMNA | |
| SCHEMBL3699746 | 0.68 | OPRM1 (0.43) | BCHEACHEOPRM1SLC6A2SLC6A3 | |
| SCHEMBL21864736 | 0.67 | GSK3B (0.40) | KDM4EALDH1A1LMNAL3MBTL1IKBKE |
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 |
|---|---|---|---|---|---|---|---|
| EP-1730140-B1 | OPIOID RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-06-25 | — | — | EP | disclosed |