Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL10750706 | 0.78 | CYP3A4 (0.35) | CYP3A4TSHRMAPK1 | |
| SCHEMBL9327624 | 0.73 | TDP1 (0.39) | CYP3A4MAPK1 | |
| SCHEMBL9329307 | 0.73 | TDP1 (0.39) | CYP3A4 | |
| SCHEMBL3833807 | 0.71 | CYP3A4 (0.38) | CYP3A4TSHRMAPK1 | |
| SCHEMBL10976039 | 0.67 | CYP3A4 (0.35) | CYP3A4TSHRMAPK1 | |
| SCHEMBL8109982 | 0.65 | TSHR (0.57) | CYP3A4TSHRMAPK1 | |
| SCHEMBL39444 | 0.65 | TSHR (0.57) | CYP3A4TSHRMAPK1 | |
| SCHEMBL11313294 | 0.63 | CYP3A4 (0.32) | CYP3A4TSHRMAPK1 | |
| SCHEMBL9329893 | 0.63 | RAPGEF4 (0.42) | — | |
| Calcium Chloride SCHEMBL28286169 | 0.62 | CYP3A4 (0.47) | CYP3A4TSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5283350-A | Aryl esters of phosphonous halides and a process for the preparation thereof | HOECHST AKTIENGESELLSHAFT (DE) | 1994-02-01 | — | — | US | disclosed |