Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 7/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | HBB | P68871 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7678258 | 0.94 | CYP2A6 (0.50) | CYP2A6CYP1A2ALDH1A1CYP3A4HSD17B10 | |
| Anthracene SCHEMBL29572399 | 0.80 | CYP2A6 (0.58) | CYP2A6CYP1A2ALDH1A1CYP3A4HSD17B10 | |
| Anthracene SCHEMBL3790663 | 0.80 | CYP2A6 (0.58) | CYP2A6CYP1A2ALDH1A1CYP3A4HSD17B10 | |
| Ammonia Solution, Strong SCHEMBL15939955 | 0.77 | ALDH1A1 (0.58) | CYP2A6CYP1A2ALDH1A1CYP3A4HSD17B10 | |
| Dimethylamine SCHEMBL28410171 | 0.77 | CYP2A6 (0.47) | CYP2A6CYP1A2ALDH1A1CYP3A4HSD17B10 | |
| Anthracene SCHEMBL27958925 | 0.77 | CYP2A6 (0.54) | CYP2A6CYP1A2ALDH1A1CYP3A4HSD17B10 | |
| Naphthalene SCHEMBL2263115 | 0.77 | CYP2A6 (0.67) | CYP2A6CYP1A2ALDH1A1CYP3A4HSD17B10 | |
| Phenanthrene SCHEMBL11570724 | 0.75 | ALDH1A1 (0.75) | CYP2A6CYP1A2ALDH1A1CYP3A4HSD17B10 | |
| Anthracene SCHEMBL29352043 | 0.74 | CYP2A6 (0.64) | CYP2A6CYP1A2ALDH1A1CYP3A4HSD17B10 | |
| Anthracene SCHEMBL7703 | 0.74 | CYP2A6 (0.64) | CYP2A6CYP1A2ALDH1A1CYP3A4HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105037167-A | Synthetic method of N, N-diaryl-2-bromine-6-naphthylamine and application thereof | UNIV SOUTH CHINA TECH | 2015-11-11 | — | — | CN | claimed |
| CN-101634725-B | Blue coloring composition for color filter, color filter and colour display device | 东洋油墨制造株式会社 | 2016-10-05 | — | — | CN | disclosed |
| CN-105037167-A | Synthetic method of N, N-diaryl-2-bromine-6-naphthylamine and application thereof | UNIV SOUTH CHINA TECH | 2015-11-11 | — | — | CN | disclosed |