Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.40 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.40 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.40 |
| ▸ | FCER2 | P06734 | 2/20 | 0.40 |
| ▸ | TACR1 | P25103 | 3/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MC5R | P33032 | 2/20 | 0.38 |
| ▸ | MC1R | Q01726 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL7277361 | 1.00 | HTR2A (0.43) | HTR2AHTR2CHTR2BPPARGPPARA | |
| SCHEMBL7291154 | 0.86 | HTR2A (0.41) | HTR2AHTR2CHTR2BPPARGPPARA | |
| SCHEMBL27522583 | 0.83 | SRR (0.42) | PPARGPPARASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL27522582 | 0.83 | SRR (0.42) | PPARGPPARASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL4263442 | 0.83 | SRR (0.42) | PPARGPPARASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL7291159 | 0.83 | HTR2A (0.44) | HTR2AHTR2CHTR2BPPARGPPARA | |
| SCHEMBL7276239 | 0.77 | PPARG (0.45) | HTR2AHTR2CHTR2BPPARGPPARA | |
| SCHEMBL7276245 | 0.77 | PPARG (0.45) | HTR2AHTR2CHTR2BPPARGPPARA | |
| SCHEMBL7291165 | 0.77 | HTR2A (0.39) | HTR2AHTR2CHTR2BPPARGPPARA | |
| SCHEMBL8918692 | 0.72 | TACR1 (0.46) | HTR2AHTR2CHTR2BFCER2TACR1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5620987-A | Amino acid derivatives | HOFFMANN-LA ROCHE INC. (US) | 1997-04-15 | — | — | US | disclosed |
| US-5554756-A | PROTEASE INHIBITOR | HOFFMANN-LA ROCHE INC. (US) | 1996-09-10 | — | — | US | disclosed |
| EP-0346847-B1 | Amino acid derivatives | HOFFMANN LA ROCHE (CH) | 1994-05-11 | — | — | EP | disclosed |
| US-5157041-A | Viricides | HOFFMANN-LA ROCHE INC. (US) | 1992-10-20 | — | — | US | disclosed |
| EP-0346847-A2 | Amino acid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1989-12-20 | — | — | EP | disclosed |