Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | NQO2 | P16083 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.35 |
| ▸ | TYMS | P04818 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1547868 | 0.84 | ALDH1A1 (0.61) | ALDH1A1CYP3A4TDP1MAPK1KMT2A | |
| SCHEMBL12990555 | 0.78 | HTR6 (0.47) | HTR6ALDH1A1CYP3A4TDP1KMT2A | |
| SCHEMBL13677416 | 0.78 | HTR6 (0.42) | HTR6ALDH1A1CYP3A4TDP1KMT2A | |
| SCHEMBL116606 | 0.78 | ALDH1A1 (0.69) | HTR6ALDH1A1CYP3A4TDP1MAPK1 | |
| SCHEMBL5800828 | 0.78 | ALDH1A1 (0.59) | HTR6ALDH1A1CYP3A4NR4A1TDP1 | |
| SCHEMBL21337861 | 0.76 | HTR6 (0.50) | HTR6ALDH1A1CYP3A4NR4A1TDP1 | |
| SCHEMBL21611343 | 0.76 | ALDH1A1 (0.65) | HTR6ALDH1A1CYP3A4TDP1MAPK1 | |
| Hydrochloric Acid SCHEMBL3275940 | 0.76 | ALDH1A1 (0.65) | HTR6ALDH1A1CYP3A4TDP1MAPK1 | |
| Ammonia Solution, Strong SCHEMBL10988442 | 0.76 | ALDH1A1 (0.65) | HTR6ALDH1A1CYP3A4TDP1MAPK1 | |
| SCHEMBL30365875 | 0.76 | ALDH1A1 (0.65) | HTR6ALDH1A1CYP3A4TDP1MAPK1 |
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-2015086676-A1 | METHOD FOR DYEING KERATINOUS SUBSTANCES STARTING FROM COLOURED OLIGOMERS AND/OR POLYMERS RESULTING FROM META-PHENYLENEDIAMINES, COMPOSITION AND DYEING AGENT | L'OREAL (FR) | 2015-06-18 | — | — | WO | disclosed |