Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 4/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ORAI1 | Q96D31 | 2/20 | 0.33 |
| ▸ | ORAI2 | Q96SN7 | 2/20 | 0.33 |
| ▸ | ORAI3 | Q9BRQ5 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | LIPE | Q05469 | 1/20 | 0.32 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.31 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | RBP4 | P02753 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL262207 | 0.81 | ENPP2 (0.46) | ENPP2CA4CA6CA5ACA7 | |
| Fluoride SCHEMBL28835775 | 0.79 | ENPP2 (0.44) | ENPP2CA4CA6CA5ACA7 | |
| SCHEMBL30038787 | 0.79 | ALDH1A1 (0.52) | ENPP2CA4CA6CA5ACA7 | |
| SCHEMBL26450 | 0.79 | ALDH1A1 (0.52) | ENPP2CA4CA6CA5ACA7 | |
| SCHEMBL1507181 | 0.74 | TDP1 (0.46) | ENPP2CA4CA6CA5ACA7 | |
| SCHEMBL7546619 | 0.74 | TDP1 (0.41) | ENPP2CA4CA6CA5ACA7 | |
| SCHEMBL3426499 | 0.74 | ALDH1A1 (0.46) | ENPP2CA4CA6CA5ACA7 | |
| SCHEMBL28107367 | 0.73 | ENPP2 (0.71) | ENPP2CA4CA7CA14TDP1 | |
| SCHEMBL3419277 | 0.71 | ENPP2 (0.43) | ENPP2TDP1ALDH1A1TSHRORAI1 | |
| SCHEMBL4055347 | 0.70 | ENPP2 (0.37) | ENPP2TDP1ALDH1A1ORAI1ORAI2 |
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-106117256-A | β phenanthro-azepine fluorine boron two pyrylium dyes and its preparation method and application | 安徽师范大学 | 2016-11-16 | — | — | CN | disclosed |