Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.67 |
| ▸ | PPARG | P37231 | 1/20 | 0.58 |
| ▸ | PPARA | Q07869 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.53 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.53 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.53 |
| ▸ | ALB | P02768 | 1/20 | 0.53 |
| ▸ | ESR1 | P03372 | 1/20 | 0.53 |
| ▸ | RARB | P10826 | 1/20 | 0.53 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Acetophenone SCHEMBL22033274 | 0.96 | LMNA (0.61) | LMNAPPARGPPARAKMT2ASMN1; SMN2 | |
| SCHEMBL585471 | 0.92 | LMNA (0.64) | LMNAKMT2ASMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL16800154 | 0.87 | LMNA (0.59) | LMNAKMT2ASMN1; SMN2MEN1ALDH1A1 | |
| Isobutylbenzene SCHEMBL6648882 | 0.86 | PTGS1 (0.57) | LMNAPTGS1PTGS2CYP2C9AKR1C3 | |
| Isobutylbenzene SCHEMBL28116998 | 0.86 | PTGS1 (0.57) | LMNAPTGS1PTGS2CYP2C9AKR1C3 | |
| Acetophenone SCHEMBL22033275 | 0.85 | LMNA (0.49) | LMNAPPARGPPARAKMT2ASMN1; SMN2 | |
| Isobutylbenzene SCHEMBL27955709 | 0.84 | PTGS1 (0.59) | LMNAPTGS1PTGS2CYP2C9AKR1C3 | |
| SCHEMBL5018743 | 0.83 | PTGS1 (0.55) | LMNAPPARGPPARASMN1; SMN2ALDH1A1 | |
| Isobutylbenzene SCHEMBL6514302 | 0.82 | PTGS1 (0.59) | LMNAPTGS1PTGS2CYP2C9AKR1C3 | |
| SCHEMBL9374371 | 0.82 | HPGD (0.66) | LMNAPPARGPPARAKMT2ASMN1; SMN2 |
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-0374850-B1 | Method for preparing alpha-(4-isobutylphenyl)propionic acid or its precursor | NIPPON PETROCHEMICALS CO LTD (JP) | 1994-03-09 | — | — | EP | disclosed |