Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.71 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 9/20 | 0.51 |
| ▸ | CYP1A1 | P04798 | 8/20 | 0.51 |
| ▸ | CYP1B1 | Q16678 | 8/20 | 0.51 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.47 |
| ▸ | TYR | P14679 | 1/20 | 0.47 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.44 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL29136568 | 0.90 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL5566174 | 0.84 | ALDH1A1 (0.80) | ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL96291 | 0.84 | ALDH1A1 (1.00) | ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1 | |
| Hydrochloric Acid SCHEMBL9456784 | 0.82 | ALDH1A1 (0.96) | ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1 | |
| Dioxane SCHEMBL8903630 | 0.81 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1 | |
| Ethylene SCHEMBL4914414 | 0.81 | ALDH1A1 (0.92) | ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1 | |
| Formaldehyde SCHEMBL28854145 | 0.81 | ALDH1A1 (0.92) | ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL702232 | 0.80 | ALDH1A1 (0.71) | ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL1748666 | 0.80 | ALDH1A1 (0.71) | ALDH1A1L3MBTL1CYP1A2CYP1A1CYP1B1 | |
| Ethylene SCHEMBL8310436 | 0.79 | ERN1 (0.44) | ALDH1A1L3MBTL1CYP1A2TRIM24TYR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE40901-E1 | Taxane derivatives and processes for the preparation thereof | INDENA S.P.A. (IT) | 2009-09-01 | — | — | US | disclosed |
| EP-1529777-B1 | Process and oxazolidine intermediate for the synthesis of taxanes | INDENA SPA (IT) | 2007-01-03 | — | — | EP | disclosed |
| US-6906101-B1 | 14- Beta -hydroxy-1,14-carbonate-baccatine III and V derivatives, 13-substituted by an isoserine residue; remarkable cytotoxic and anticarcinogenic-agent activities; capable of overcoming the resistance of cell lines expressing the multidrug resistant phenotype; breast, ovarian, colon cancers | INDENA S.P.A. (IT) | 2005-06-14 | — | — | US | disclosed |
| EP-1529777-A2 | Process and oxazolidine intermediate for the synthesis of taxanes | INDENA S.p.A. (IT) | 2005-05-11 | — | — | EP | disclosed |
| EP-1192162-B1 | TAXANE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | INDENA SPA (IT) | 2004-09-29 | — | — | EP | disclosed |