Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 3/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.48 |
| ▸ | DRD2 | P14416 | 3/20 | 0.48 |
| ▸ | HTR7 | P34969 | 3/20 | 0.48 |
| ▸ | HTR6 | P50406 | 3/20 | 0.48 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.47 |
| ▸ | HTR2A | P28223 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.46 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5527597 | 0.92 | CYP2D6 (0.52) | CYP2D6SLC6A4ADRA1DKMT2A | |
| SCHEMBL6962409 | 0.91 | CYP2D6 (0.48) | CYP2D6SLC6A4ADRA1DOPRM1OPRK1 | |
| SCHEMBL6969325 | 0.91 | DRD2 (0.55) | HTR1ASLC6A4DRD2HTR7HTR6 | |
| SCHEMBL6955450 | 0.89 | DRD2 (0.53) | HTR1ASLC6A4DRD2HTR7HTR6 | |
| SCHEMBL6969178 | 0.88 | SIGMAR1 (0.57) | HTR1ASLC6A4DRD2HTR7HTR6 | |
| SCHEMBL6966928 | 0.88 | SIGMAR1 (0.57) | HTR1ASLC6A4DRD2HTR7HTR6 | |
| SCHEMBL6966376 | 0.88 | CCR2 (0.47) | CYP2D6SLC6A4ADRA1D | |
| SCHEMBL6956812 | 0.85 | DRD2 (0.48) | HTR1ASLC6A4DRD2OPRM1OPRK1 | |
| SCHEMBL6957106 | 0.85 | DRD2 (0.48) | HTR1ASLC6A4DRD2OPRM1OPRK1 | |
| SCHEMBL6968059 | 0.85 | DRD2 (0.48) | HTR1ASLC6A4DRD2OPRM1OPRK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0964863-B1 | OXAZOLIDINES AS 5-HT2A-ANTAGONISTS | MERCK PATENT GMBH (DE) | 2003-05-21 | — | — | EP | disclosed |
| EP-0964863-A1 | OXAZOLIDINES AS 5-HT2A-ANTAGONISTS | MERCK PATENT GmbH (DE) | 1999-12-22 | — | — | EP | disclosed |
| WO-1998038189-A1 | OXAZOLIDINES AS 5-HT2A-ANTAGONISTS | MERCK PATENT GMBH (DE) | 1998-09-03 | — | — | WO | disclosed |