Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 8/20 | 0.39 |
| ▸ | CA2 | P00918 | 8/20 | 0.39 |
| ▸ | CA9 | Q16790 | 7/20 | 0.39 |
| ▸ | LPAR3 | Q9UBY5 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA7 | P43166 | 3/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.39 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.39 |
| ▸ | LPAR2 | Q9HBW0 | 2/20 | 0.39 |
| ▸ | CA3 | P07451 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA6 | P23280 | 2/20 | 0.39 |
| ▸ | CA5A | P35218 | 2/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL3820336 | 0.98 | CA1 (0.40) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL3818180 | 0.98 | CA1 (0.40) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL3816390 | 0.98 | CA1 (0.40) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL3821981 | 0.98 | CA1 (0.40) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL28098806 | 0.95 | CA1 (0.39) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL28098925 | 0.95 | CA1 (0.39) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL3822338 | 0.95 | CA1 (0.38) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL29184188 | 0.91 | CYP3A4 (0.37) | CA1CA2TSHRHPGD | |
| SCHEMBL2484211 | 0.91 | CA1 (0.30) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL11428681 | 0.91 | CA1 (0.30) | CA1CA2CA9LPAR3CA12 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115028660-A | Method for synthesizing 2-ethylhexyl phosphonic acid di (2-ethyl) hexyl ester by taking 2-ethylhexyl sodium alkoxide as alkali | 三门峡中达化工有限公司 | 2022-09-09 | — | — | CN | disclosed |