Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
| ▸ | MMP12 | P39900 | 3/20 | 0.40 |
| ▸ | MMP13 | P45452 | 3/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | MMP14 | P50281 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | S1PR2 | O95136 | 3/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL4063592 | 0.82 | CNR2 (0.49) | PPARGPPARAMMP12MMP13MMP2 | |
| SCHEMBL6628999 | 0.82 | CNR2 (0.49) | PPARGPPARAMMP12MMP13MMP2 | |
| SCHEMBL11835990 | 0.80 | MMP12 (0.63) | MMP12MMP13MMP2MMP9MMP14 | |
| SCHEMBL22444711 | 0.78 | GRIK1 (0.53) | ALDH1A1TAAR1S1PR2S1PR1S1PR3 | |
| SCHEMBL11826787 | 0.78 | ALDH1A1 (0.47) | ALDH1A1TAAR1PPARGPPARATAS1R3 | |
| SCHEMBL13061661 | 0.76 | ALDH1A1 (0.48) | ALDH1A1TAAR1PPARGPPARATAS1R3 | |
| SCHEMBL22444710 | 0.75 | MME (0.48) | ALDH1A1MAPTPPARGPPARATAS1R3 | |
| SCHEMBL28308177 | 0.73 | ALDH1A1 (0.50) | ALDH1A1PPARGPPARAAKR1C3AKR1C2 | |
| SCHEMBL5613464 | 0.73 | MMP12 (0.77) | MMP12MMP13MMP2MMP9MMP14 | |
| SCHEMBL28314822 | 0.72 | ALDH1A1 (0.54) | ALDH1A1PPARGPPARATAS1R3TAS1R1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105085433-B | Substituted amide phenol compound and preparation method thereof, pharmaceutical composition and purposes | 中国科学院上海药物研究所 | 2019-06-25 | — | — | CN | disclosed |
| CN-105085433-A | Substituted-amide phenolic compound, preparation method, pharmaceutical composition and application thereof | SHANGHAI INST MATERIA MEDICA | 2015-11-25 | — | — | CN | disclosed |