Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 4/20 | 0.43 |
| ▸ | PPARA | Q07869 | 4/20 | 0.43 |
| ▸ | ESR1 | P03372 | 7/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2783556 | 0.78 | ESR1 (0.45) | ESR1ESR2SLC6A2CHRM1TDP1 | |
| SCHEMBL2784263 | 0.78 | ESR1 (0.45) | ESR1ESR2SLC6A2CHRM1TDP1 | |
| SCHEMBL9547804 | 0.75 | ESR1 (0.44) | ESR1ESR2SLC6A2CHRM1TDP1 | |
| SCHEMBL10582278 | 0.74 | CA12 (0.54) | PPARGPPARAESR1ESR2SLC6A2 | |
| SCHEMBL9479827 | 0.74 | ESR1 (0.59) | ESR1ESR2SLC6A2CHRM1TDP1 | |
| SCHEMBL633268 | 0.74 | ESR1 (0.49) | ESR1ESR2SLC6A2CHRM1TDP1 | |
| SCHEMBL1823023 | 0.72 | ESR1 (0.47) | ESR1ESR2SLC6A2CHRM1TDP1 | |
| SCHEMBL300994 | 0.72 | ESR1 (0.47) | ESR1ESR2SLC6A2CHRM1TDP1 | |
| SCHEMBL2098150 | 0.72 | ESR1 (0.47) | ESR1ESR2SLC6A2CHRM1TDP1 | |
| SCHEMBL28028444 | 0.72 | FFAR1 (0.50) | PPARGPPARACYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2012500846-A | — | — | 2012-01-12 | — | — | JP | claimed |
| EP-2315739-A1 | NEW PROPANOATES AND PROCESSES FOR PREPARING THE SAME | DuPont Electronic Polymers L.P. (US) | 2011-05-04 | — | — | EP | claimed |