Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | CA6 | P23280 | 1/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.45 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.45 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.45 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.45 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.45 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | GLA | P06280 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Anthracene SCHEMBL5441687 | 0.97 | CA1 (0.55) | CA1CA2CYP1A2CA4CA6 | |
| Anthracene SCHEMBL28321035 | 0.97 | CA1 (0.55) | CA1CA2CYP1A2CA4CA6 | |
| Anthracene SCHEMBL28700597 | 0.93 | CA1 (0.52) | CA1CA2CYP1A2CA7ALDH1A1 | |
| Benz(B)Anthracene SCHEMBL31364320 | 0.93 | CA1 (0.52) | CA1CA2CYP1A2CA7ALDH1A1 | |
| Anthracene SCHEMBL18037719 | 0.89 | CYP2A6 (0.54) | CA1CA2CYP1A2CA4CA7 | |
| Anthracene SCHEMBL202403 | 0.86 | CYP2A6 (0.58) | CA1CA2CYP1A2CA7ALDH1A1 | |
| Anthracene SCHEMBL28676845 | 0.86 | CYP2A6 (0.58) | CA1CA2CYP1A2CA7ALDH1A1 | |
| Anthracene SCHEMBL5713444 | 0.86 | CYP2A6 (0.58) | CA1CA2CYP1A2CA7ALDH1A1 | |
| Benzene SCHEMBL23327304 | 0.82 | ALDH1A1 (0.58) | CA1CA2CYP1A2CA7ALDH1A1 | |
| Anthracene SCHEMBL17912426 | 0.82 | CYP2A6 (0.67) | CA1CA2CYP1A2CA7ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109503427-A | A kind of organic blue fluorescent material of D-A type and its preparation method and application | 陕西师范大学 | 2019-03-22 | — | — | CN | disclosed |