Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 3/20 | 0.47 |
| ▸ | PPARG | P37231 | 2/20 | 0.47 |
| ▸ | PPARD | Q03181 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19919385 | 0.87 | ALDH1A1 (0.65) | PTGS1ALDH1A1ALOX5CYP3A4AR | |
| SCHEMBL13492249 | 0.81 | PTGS2 (0.46) | PTGS1ALDH1A1ALOX5CYP3A4AR | |
| SCHEMBL557409 | 0.77 | ALDH1A1 (0.69) | PTGS1ALDH1A1CYP3A4PPARAPPARG | |
| SCHEMBL30644304 | 0.77 | ALDH1A1 (0.69) | PTGS1ALDH1A1CYP3A4PPARAPPARG | |
| SCHEMBL29520102 | 0.76 | ALDH1A1 (0.72) | PTGS1ALDH1A1ALOX5CYP3A4AR | |
| SCHEMBL917723 | 0.76 | ALDH1A1 (0.72) | PTGS1ALDH1A1ALOX5CYP3A4AR | |
| SCHEMBL3343652 | 0.75 | ALDH1A1 (0.67) | PTGS1ALDH1A1CYP3A4PPARAPPARG | |
| SCHEMBL3213308 | 0.75 | DRD2 (0.49) | ALDH1A1ALOX5PPARAPPARGMEN1 | |
| SCHEMBL16865526 | 0.74 | ALDH1A1 (0.50) | PTGS1ALDH1A1ALOX5CYP3A4AR | |
| SCHEMBL17537954 | 0.74 | ALDH1A1 (0.50) | PTGS1ALDH1A1ALOX5CYP3A4AR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7625949-B2 | Methods for treating retroviral infections | ROCHE PALO ALTO LLC (US) | 2009-12-01 | — | — | US | disclosed |
| US-7348345-B2 | Nonnucleoside reverse transcriptase inhibitors | ROCHE PALO ALTO LLC (US) | 2008-03-25 | — | — | US | disclosed |