Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | MMP1 | P03956 | 1/20 | 0.30 |
| ▸ | MMP2 | P08253 | 1/20 | 0.30 |
| ▸ | MMP3 | P08254 | 1/20 | 0.30 |
| ▸ | MMP9 | P14780 | 1/20 | 0.30 |
| ▸ | MMP13 | P45452 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Butanone SCHEMBL29275306 | 0.92 | TDP1 (0.57) | TDP1ALDH1A1CYP2C19ACHECA2 | |
| SCHEMBL28357119 | 0.92 | TDP1 (0.59) | TDP1ALDH1A1CYP2C19ACHECA2 | |
| Methyl Isobutyl Ketone SCHEMBL691876 | 0.87 | TDP1 (0.74) | TDP1ALDH1A1CYP2C19ACHECA2 | |
| Methyl Isobutyl Ketone SCHEMBL8231134 | 0.85 | TDP1 (0.70) | TDP1ALDH1A1CYP2C19ACHECA2 | |
| SCHEMBL103502 | 0.84 | — | — | |
| Acetic Acid SCHEMBL8922876 | 0.82 | TDP1 (0.50) | TDP1ALDH1A1CYP2C19ACHECA2 | |
| Methyl Isobutyl Ketone SCHEMBL306141 | 0.81 | ALDH1A1 (0.82) | TDP1ALDH1A1CYP2C19CA2POLB | |
| Hydrochloric Acid SCHEMBL8921344 | 0.81 | — | — | |
| Methyl Isobutyl Ketone SCHEMBL6253907 | 0.81 | ALDH1A1 (0.82) | TDP1ALDH1A1CYP2C19ACHECA2 | |
| Acetone SCHEMBL10786728 | 0.81 | ALDH1A1 (0.61) | TDP1ALDH1A1CYP2C19ACHECA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007037540-A1 | CELLULOSE ACYLATE FILM, METHOD FOR PRODUCING SAME, OPTICALLY COMPENSATORY FILM, ANTI-REFLECTION FILM, POLARIZING PLATE AND IMAGE DISPLAY DEVICE | FUJIFILM CORPORATION (JP) | 2007-04-05 | — | — | WO | disclosed |