Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 4/20 | 0.73 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.46 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.46 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 6/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 6/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28948432 | 1.00 | ENPP2 (0.73) | ENPP2CA1CA2HSD17B2HSD17B1 | |
| SCHEMBL7344145 | 0.85 | ENPP2 (1.00) | ENPP2CA1CA2NLRP3ACHE | |
| SCHEMBL5140 | 0.85 | ENPP2 (1.00) | ENPP2CA1CA2NLRP3ACHE | |
| SCHEMBL20979821 | 0.85 | ACHE (0.54) | ENPP2CA1CA2HSD17B2HSD17B1 | |
| SCHEMBL31256052 | 0.85 | ACHE (0.54) | ENPP2CA1CA2HSD17B2HSD17B1 | |
| Methyl Alcohol SCHEMBL28712606 | 0.83 | ENPP2 (0.96) | ENPP2CA1CA2NLRP3ACHE | |
| SCHEMBL8944101 | 0.82 | HSD17B2 (0.50) | ENPP2CA1CA2HSD17B2HSD17B1 | |
| SCHEMBL14163837 | 0.81 | ACHE (0.50) | ENPP2CA1CA2HSD17B2HSD17B1 | |
| SCHEMBL20386564 | 0.80 | CA4 (0.52) | ENPP2CA1CA2HSD17B2HSD17B1 | |
| SCHEMBL1134073 | 0.80 | CA4 (0.52) | ENPP2CA1CA2HSD17B2HSD17B1 |
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-115677700-A | Phenyl o-phenanthroline pyrazine compound and preparation method and application thereof | 太原理工大学 | 2023-02-03 | — | — | CN | disclosed |