Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.38 |
| ▸ | LPL | P06858 | 1/20 | 0.32 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.32 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.32 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.32 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.32 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.32 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.32 |
| ▸ | APP | P05067 | 2/20 | 0.31 |
| ▸ | TPMT | P51580 | 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 | |
|---|---|---|---|---|
| SCHEMBL19712851 | 0.80 | ORAI1 (0.35) | CA2CA1ENPP2ORAI1ORAI2 | |
| SCHEMBL1290227 | 0.78 | ENPP2 (0.52) | CA2CA1ENPP2APP | |
| SCHEMBL26386588 | 0.78 | TPMT (0.32) | CA2CA1ENPP2TPMT | |
| SCHEMBL14282970 | 0.78 | CA2 (0.56) | CA2CA1ENPP2LPLLIPG | |
| SCHEMBL16247935 | 0.76 | ORAI1 (0.54) | CA2CA1ENPP2LPLLIPG | |
| SCHEMBL13686655 | 0.76 | CA1 (0.67) | CA2CA1ENPP2PRSS1PRSS2 | |
| SCHEMBL5926479 | 0.76 | TDP1 (0.42) | CA2CA1ENPP2F2PRSS1 | |
| SCHEMBL14068806 | 0.76 | ENPP2 (0.54) | CA2CA1ENPP2LPLLIPG | |
| SCHEMBL691860 | 0.75 | ENPP2 (0.50) | CA2CA1ENPP2ORAI1ORAI2 | |
| SCHEMBL22960487 | 0.74 | ENPP2 (0.41) | CA2CA1ENPP2ORAI1ORAI2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023131333-A1 | BENZIMIDAZOLE COMPOUND AND MEDICAL USE THEREOF | 中国科学院上海药物研究所 | 2023-07-13 | — | — | WO | disclosed |