Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G2A | P14555 | 1/20 | 0.45 |
| ▸ | TPMT | P51580 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12446177 | 0.86 | PLA2G2A (0.47) | PLA2G2ATPMTCA1CA2CA12 | |
| SCHEMBL13066205 | 0.86 | PLA2G2A (0.52) | PLA2G2ATPMTCA1CA2CA12 | |
| SCHEMBL585918 | 0.85 | CA1 (0.50) | PLA2G2ATPMTCA1CA2CA12 | |
| SCHEMBL31032776 | 0.85 | CA1 (0.50) | PLA2G2ATPMTCA1CA2CA12 | |
| SCHEMBL29784186 | 0.81 | PLA2G2A (0.53) | PLA2G2APKMPOLBHSD17B10KMT2A | |
| SCHEMBL2279445 | 0.81 | PLA2G2A (0.53) | PLA2G2APKMPOLBHSD17B10KMT2A | |
| SCHEMBL12446094 | 0.81 | RXRA (0.50) | PLA2G2ATPMTCA1CA2CA12 | |
| SCHEMBL14538306 | 0.81 | PLA2G2A (0.41) | PLA2G2ATPMTCA1CA2CA12 | |
| SCHEMBL30091972 | 0.80 | PLA2G2A (0.55) | PLA2G2APKMPOLBKMT2AMEN1 | |
| SCHEMBL17823602 | 0.80 | PLA2G2A (0.55) | PLA2G2APKMPOLBKMT2AMEN1 |
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-2010021680-A2 | INHIBITORS OF BETA-SECRETASE | VITAE PHARMACEUTICALS, INC. (US) | 2010-02-25 | — | — | WO | disclosed |