Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 15/20 | 0.69 |
| ▸ | HTR2C | P28335 | 9/20 | 0.69 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.69 |
| ▸ | DRD2 | P14416 | 6/20 | 0.69 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.46 |
| ▸ | MGAM | O43451 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SI | P14410 | 1/20 | 0.46 |
| ▸ | MGAM2 | Q2M2H8 | 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 | |
|---|---|---|---|---|
| SCHEMBL7955986 | 0.90 | HTR2A (0.67) | HTR2AHTR2CKCNH2DRD2TLR9 | |
| SCHEMBL7962348 | 0.89 | HTR2A (0.75) | HTR2AHTR2CKCNH2DRD2 | |
| SCHEMBL7948431 | 0.86 | HTR2A (0.85) | HTR2AHTR2CKCNH2DRD2 | |
| SCHEMBL7958671 | 0.85 | HTR2A (0.80) | HTR2AHTR2CKCNH2DRD2OPRM1 | |
| SCHEMBL7955993 | 0.84 | HTR2A (0.78) | HTR2AHTR2CKCNH2DRD2OPRM1 | |
| SCHEMBL7948435 | 0.84 | HTR2A (0.78) | HTR2AHTR2CKCNH2DRD2 | |
| SCHEMBL7948282 | 0.83 | HTR2A (0.80) | HTR2AHTR2CKCNH2DRD2OPRM1 | |
| SCHEMBL7957757 | 0.83 | HTR2A (0.76) | HTR2AHTR2CKCNH2DRD2 | |
| SCHEMBL7948536 | 0.82 | HTR2A (0.68) | HTR2AHTR2CKCNH2DRD2TLR9 | |
| SCHEMBL7948313 | 0.82 | HTR2A (1.00) | HTR2AHTR2CKCNH2DRD2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6316468-B1 | Phenylindole derivatives as 5-HT2A receptor antagonists | MERCK SHARP & DOHME LTD. | 2001-11-13 | — | — | US | claimed |
| WO-1999011641-A1 | PHENYLINDOLE DERIVATIVES AS 5-HT2A RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1999-03-11 | — | — | WO | claimed |
| US-6316468-B1 | Phenylindole derivatives as 5-HT2A receptor antagonists | MERCK SHARP & DOHME LTD. | 2001-11-13 | — | — | US | disclosed |
| WO-1999011641-A1 | PHENYLINDOLE DERIVATIVES AS 5-HT2A RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1999-03-11 | — | — | WO | disclosed |