Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | KDM1A | O60341 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.41 |
| ▸ | CCR2 | P41597 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | ICMT | O60725 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18016890 | 0.82 | SLC6A4 (0.33) | SLC6A4SLC6A3SLC6A2OPRM1OPRK1 | |
| SCHEMBL19273962 | 0.80 | SLC6A4 (0.57) | SLC6A4SLC6A3SLC6A2KDM1AOPRM1 | |
| SCHEMBL12197954 | 0.78 | SLC6A3 (0.47) | SLC6A4SLC6A3SLC6A2OPRM1 | |
| SCHEMBL12000528 | 0.78 | SLC6A4 (0.58) | SLC6A4SLC6A3SLC6A2KDM1AALDH1A1 | |
| SCHEMBL19647173 | 0.77 | MAOA (0.54) | SLC6A4SLC6A3SLC6A2OPRM1OPRK1 | |
| SCHEMBL23997040 | 0.77 | SLC6A4 (0.53) | SLC6A4SLC6A3SLC6A2KDM1AOPRM1 | |
| SCHEMBL3223371 | 0.77 | MAOA (0.59) | SLC6A4SLC6A3SLC6A2KDM1AHTR2A | |
| SCHEMBL872384 | 0.76 | SLC6A3 (0.50) | SLC6A4SLC6A3SLC6A2KDM1AHTR2A | |
| SCHEMBL23511344 | 0.76 | SLC6A4 (0.53) | SLC6A4SLC6A3SLC6A2KDM1AOPRM1 | |
| SCHEMBL23341012 | 0.73 | SLC6A4 (0.62) | SLC6A4SLC6A3SLC6A2OPRM1OPRK1 |
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-1589029-B1 | Pyrazinone protease inhibitors | ORTHO MCNEIL PHARM INC (US) | 2010-03-17 | — | — | EP | disclosed |