Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 4/20 | 0.44 |
| ▸ | ORAI1 | Q96D31 | 4/20 | 0.44 |
| ▸ | ORAI2 | Q96SN7 | 4/20 | 0.44 |
| ▸ | ORAI3 | Q9BRQ5 | 4/20 | 0.44 |
| ▸ | TRPV6 | Q9H1D0 | 4/20 | 0.44 |
| ▸ | CA4 | P22748 | 2/20 | 0.44 |
| ▸ | PCSK9 | Q8NBP7 | 2/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | MGLL | Q99685 | 2/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL262207 | 0.98 | ENPP2 (0.46) | ENPP2ORAI1ORAI2ORAI3TRPV6 | |
| Tetrahydrofuran SCHEMBL28301963 | 0.87 | CA4 (0.34) | ENPP2ORAI1ORAI2ORAI3TRPV6 | |
| SCHEMBL28107366 | 0.79 | ENPP2 (0.37) | ENPP2ORAI1ORAI2ORAI3TRPV6 | |
| SCHEMBL691860 | 0.78 | ENPP2 (0.50) | ENPP2ORAI1ORAI2ORAI3TRPV6 | |
| SCHEMBL28135433 | 0.77 | CYP2D6 (0.37) | TSHR | |
| Water SCHEMBL28105163 | 0.76 | ENPP2 (0.48) | ENPP2ORAI1ORAI2ORAI3TRPV6 | |
| Ammonia Solution, Strong SCHEMBL28166457 | 0.76 | ENPP2 (0.48) | ENPP2ORAI1ORAI2ORAI3TRPV6 | |
| SCHEMBL28097813 | 0.76 | CYP1A2 (0.32) | ENPP2CA1CA2 | |
| SCHEMBL26924069 | 0.76 | ORAI1 (0.50) | ENPP2ORAI1ORAI2ORAI3TRPV6 | |
| SCHEMBL3985882 | 0.75 | ACHE (0.41) | ENPP2CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103936538-B | Method for preparing phenol by performing catalytic oxidation on aryl boron compound | 南京师范大学 | 2017-02-15 | — | — | CN | disclosed |
| CN-106008475-A | Coumarin NEDD8 activating enzyme inhibitor | 南京工业大学 | 2016-10-12 | — | — | CN | disclosed |