Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.51 |
| ▸ | CA9 | Q16790 | 4/20 | 0.51 |
| ▸ | CA2 | P00918 | 3/20 | 0.51 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | STAT3 | P40763 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL31606584 | 0.84 | CA12 (0.49) | CA12CA9CA2CA1GAA | |
| SCHEMBL8475244 | 0.79 | MAPT (0.55) | CA12CA9CA2CA1GAA | |
| SCHEMBL15661681 | 0.78 | GAA (0.50) | CA12CA9CA2CA1GAA | |
| SCHEMBL20230385 | 0.78 | GAA (0.48) | CA12CA9CA2CA1GAA | |
| SCHEMBL28375993 | 0.77 | KEAP1 (0.51) | CA12CA9CA2CA1GAA | |
| SCHEMBL1998361 | 0.77 | STAT3 (0.78) | CA12CA9CA2CA1CYP3A4 | |
| SCHEMBL8768499 | 0.76 | ALDH1A1 (0.63) | CYP1A2CYP3A4ALDH1A1HPGDCYP2C9 | |
| Benzene SCHEMBL22288190 | 0.75 | STAT3 (0.48) | CA12CA9CA2CA1GAA | |
| SCHEMBL9702990 | 0.75 | ALDH1A1 (0.58) | CA12CA9CA2CA1GAA | |
| SCHEMBL7783915 | 0.75 | CA12 (0.56) | CA12CA9CA2CA1GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0791006-A2 | POLYANIONIC BENZYLGLYCOSIDES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION | AMERICAN HOME PRODUCTS CORPORATION (US) | 1997-08-27 | — | — | EP | disclosed |
| WO-1996014323-A1 | POLYANIONIC BENZYLGLYCOSIDES AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-05-17 | — | — | WO | disclosed |