Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | S100B | P04271 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6334634 | 0.82 | ALDH1A1 (0.45) | CYP3A4ALDH1A1TDP1THRBALOX15 | |
| SCHEMBL2126641 | 0.81 | CYP3A4 (0.53) | CYP3A4ALDH1A1TDP1THRBALOX15 | |
| SCHEMBL8681665 | 0.79 | ALDH1A1 (0.42) | CYP3A4ALDH1A1TDP1THRBALOX15 | |
| SCHEMBL4955016 | 0.78 | APP (0.41) | CYP3A4ALDH1A1HTTMAPTCYP1A2 | |
| SCHEMBL10495591 | 0.78 | ALDH1A1 (0.41) | CYP3A4ALDH1A1TDP1THRBALOX15 | |
| SCHEMBL14028552 | 0.78 | ALDH1A1 (0.41) | CYP3A4ALDH1A1TDP1THRBALOX15 | |
| SCHEMBL2933227 | 0.78 | ALDH1A1 (0.58) | CYP3A4ALDH1A1TDP1THRBALOX15 | |
| SCHEMBL6376391 | 0.78 | ALDH1A1 (0.53) | CYP3A4ALDH1A1TDP1THRBALOX15 | |
| SCHEMBL10875746 | 0.77 | ALDH1A1 (0.41) | CYP3A4ALDH1A1TDP1THRBALOX15 | |
| SCHEMBL4853097 | 0.77 | ALDH1A1 (0.46) | CYP3A4ALDH1A1TDP1THRBALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| US-7435267-B2 | Secondary para-phenylenediamines bearing an alkoxy group, dye composition comprising them, processes therefor and uses thereof | L'OREAL S.A. (FR) | 2008-10-14 | — | — | US | disclosed |
| US-7435267-B2 | Secondary para-phenylenediamines bearing an alkoxy group, dye composition comprising them, processes therefor and uses thereof | L'OREAL S.A. (FR) | 2008-10-14 | — | — | US | disclosed |