Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL9964974 | 0.94 | CYP1A2 (0.46) | CYP1A2CYP3A4CYP2C19AHRKDM4E | |
| SCHEMBL9936869 | 0.87 | AHR (0.44) | CYP1A2CYP3A4CYP2C19AHRKDM4E | |
| SCHEMBL9937543 | 0.86 | MAP4K1 (0.33) | CYP1A2CYP3A4CYP2C19KDM4EMAPT | |
| Hydrochloric Acid SCHEMBL9935733 | 0.85 | AHR (0.42) | CYP1A2CYP3A4CYP2C19AHRKDM4E | |
| SCHEMBL9937603 | 0.82 | KDM4E (0.30) | KDM4EMAPTGAAMEN1KMT2A | |
| SCHEMBL6446157 | 0.79 | CYP1A2 (0.61) | CYP1A2CYP3A4CYP2C19AHRKDM4E | |
| SCHEMBL9964975 | 0.79 | MAP4K1 (0.36) | CYP1A2CYP3A4CYP2C19KDM4EMAPT | |
| SCHEMBL9964969 | 0.77 | KDM4E (0.37) | AHRKDM4EMAPTGAAMEN1 | |
| SCHEMBL9965015 | 0.76 | CYP1A2 (0.46) | CYP1A2CYP3A4CYP2C19KDM4EMAPT | |
| SCHEMBL9964988 | 0.75 | KDM4E (0.51) | CYP1A2CYP3A4KDM4EMAPTGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2651516-A2 | DYE COMPOSITION COMPRISING A HETEROCYCLIC OXIDATION BASE AND A 4-AMINOINDOLE COUPLER | L'Oréal (FR) | 2013-10-23 | — | — | EP | claimed |
| WO-2012080321-A2 | DYE COMPOSITION COMPRISING A HETEROCYCLIC OXIDATION BASE AND A 4-AMINOINDOLE COUPLER | L'OREAL (FR) | 2012-06-21 | — | — | WO | claimed |
| WO-2012080285-A2 | DYE COMPOSITION COMPRISING A SECONDARY PARA-PHENYLENEDIAMINE OXIDATION BASE AND A 4-AMINOINDOLE COUPLER | L'OREAL (FR) | 2012-06-21 | — | — | WO | disclosed |