Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | L3MBTL3 | Q96JM7 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | ARG1 | P05089 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL15777327 | 0.98 | TSHR (0.34) | ESR1ESR2TSHRL3MBTL3L3MBTL1 | |
| SCHEMBL24536115 | 0.88 | CYP3A4 (0.33) | ESR1ESR2TSHR | |
| SCHEMBL22814409 | 0.86 | ESR1 (0.33) | ESR1ESR2 | |
| SCHEMBL21653767 | 0.86 | ESR1 (0.33) | ESR1ESR2 | |
| SCHEMBL5441416 | 0.86 | ESR1 (0.33) | ESR1ESR2 | |
| SCHEMBL17982511 | 0.84 | — | — | |
| SCHEMBL21384363 | 0.84 | — | — | |
| SCHEMBL21276002 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL18151443 | 0.82 | TSHR (0.37) | TSHRL3MBTL3L3MBTL1ARG1 | |
| Hydrochloric Acid SCHEMBL30069218 | 0.82 | ESR1 (0.33) | ESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018026371-A1 | DUAL NAV1.2/5HT2A INHIBITORS FOR TREATING CNS DISORDERS | SUNOVION PHARMACEUTICALS INC. (US) | 2018-02-08 | — | — | WO | disclosed |