Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR3 | Q9UBY5 | 9/20 | 0.54 |
| ▸ | LPAR2 | Q9HBW0 | 7/20 | 0.54 |
| ▸ | LPAR1 | Q92633 | 4/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | CDC25A | P30304 | 1/20 | 0.43 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.43 |
| ▸ | AKT1 | P31749 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL4450985 | 0.93 | CYP3A4 (0.58) | LPAR3LPAR2LPAR1CYP3A4TSHR | |
| SCHEMBL4456017 | 0.83 | MEN1 (0.39) | LPAR3LPAR2LPAR1CYP3A4S1PR2 | |
| SCHEMBL30531880 | 0.82 | LPAR3 (0.59) | LPAR3LPAR2LPAR1CYP3A4LMNA | |
| SCHEMBL6851777 | 0.81 | LPAR3 (0.64) | LPAR3LPAR2LPAR1CYP3A4S1PR2 | |
| SCHEMBL776765 | 0.80 | LPAR3 (0.52) | LPAR3LPAR2LPAR1CYP3A4LMNA | |
| SCHEMBL24966982 | 0.78 | LPAR3 (0.55) | LPAR3LPAR2LPAR1CYP3A4LMNA | |
| SCHEMBL24966572 | 0.78 | LPAR3 (0.55) | LPAR3LPAR2LPAR1CYP3A4LMNA | |
| SCHEMBL24966022 | 0.78 | LPAR3 (0.55) | LPAR3LPAR2LPAR1CYP3A4LMNA | |
| SCHEMBL24966972 | 0.78 | LPAR3 (0.55) | LPAR3LPAR2LPAR1CYP3A4LMNA | |
| SCHEMBL23497156 | 0.78 | LPAR3 (0.55) | LPAR3LPAR2LPAR1CYP3A4LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-107308172-A | A kind of antineoplastic containing aryl ketones phosphate compound and its application | 深圳瑞科生物科技有限公司 | 2017-11-03 | — | — | CN | disclosed |
| CN-105801622-A | Acetophenone phosphate compound and preparation method thereof | 叶芳 | 2016-07-27 | — | — | CN | disclosed |