Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 2/20 | 0.31 |
| ▸ | TDP2 | O95551 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.30 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.30 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9006888 | 0.86 | BRD4 (0.33) | BRD4PNMTTDP2ADRA2AADRA2B | |
| SCHEMBL8101761 | 0.71 | KDM1A (0.33) | BRD4PNMTTDP2ADRA2AADRA2B | |
| SCHEMBL8109768 | 0.71 | KDM1A (0.40) | BRD4PNMTTDP2ADRA2AADRA2B | |
| SCHEMBL9331447 | 0.69 | BRD4 (0.37) | BRD4TDP2 | |
| SCHEMBL18084410 | 0.66 | BRD4 (0.37) | BRD4PNMTTDP2ADRA2AADRA2B | |
| SCHEMBL9007021 | 0.65 | SLC6A4 (0.31) | — | |
| SCHEMBL1794485 | 0.65 | PNMT (0.40) | BRD4PNMTTDP2ADRA2AADRA2B | |
| SCHEMBL4417328 | 0.64 | BACE1 (0.37) | BRD4PNMTTDP2ADRA2AADRA2B | |
| SCHEMBL15797611 | 0.63 | BRD4 (0.41) | BRD4PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL4420836 | 0.62 | S100A4 (0.37) | TDP2 |
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-0405028-A1 | Thiochroman esters of phenols and terephthalates having retinoid-like activity | ALLERGAN, INC (US) | 1991-01-02 | — | — | EP | disclosed |