Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL539922 | 0.83 | ESR1 (0.43) | ESR1GAAACP3SLC6A2SLC6A4 | |
| SCHEMBL17660054 | 0.83 | ESR1 (0.46) | ESR1GAAKDM4ECYP1A2ACP3 | |
| SCHEMBL31376576 | 0.83 | ESR1 (0.46) | ESR1GAAKDM4ECYP1A2ACP3 | |
| SCHEMBL6481460 | 0.83 | ESR1 (0.46) | ESR1GAAKDM4ECYP1A2ACP3 | |
| SCHEMBL2543874 | 0.83 | ESR1 (0.46) | ESR1GAAKDM4ECYP1A2ACP3 | |
| SCHEMBL3918915 | 0.82 | ESR1 (0.42) | ESR1GAAKDM4ECYP1A2ACP3 | |
| SCHEMBL3918911 | 0.82 | ESR1 (0.42) | ESR1GAAKDM4ECYP1A2ACP3 | |
| SCHEMBL477348 | 0.82 | ESR1 (0.42) | ESR1GAAKDM4EACP3SLC6A2 | |
| SCHEMBL9796192 | 0.80 | PPARG (0.46) | ESR1GAAKDM4ELMNAALDH1A1 | |
| SCHEMBL30949071 | 0.80 | ESR1 (0.41) | ESR1GAAKDM4ECYP1A2ACP3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1838827-A1 | CONCENTRATED FABRIC SOFTENER ACTIVE COMPOSITIONS | The Procter and Gamble Company (US) | 2007-10-03 | — | — | EP | disclosed |
| WO-2006044875-A1 | CONCENTRATED FABRIC SOFTENER ACTIVE COMPOSITIONS | THE PROCTER & GAMBLE COMPANY (US) | 2006-04-27 | — | — | WO | disclosed |
| WO-1998017750-A1 | CONCENTRATED, FABRIC SOFTENING COMPOSITION | THE PROCTER & GAMBLE COMPANY (US) | 1998-04-30 | — | — | WO | disclosed |