Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ASAH1 | Q13510 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.31 |
| ▸ | MIF | P14174 | 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 | |
|---|---|---|---|---|
| SCHEMBL9716001 | 0.83 | IDO1 (0.35) | USP2HPGDTSHRMAPK1ALDH1A1 | |
| SCHEMBL9715962 | 0.80 | GAA (0.39) | ALDH1A1MIF | |
| SCHEMBL9715956 | 0.77 | IDO1 (0.38) | USP2HPGDTSHRMAPK1ALDH1A1 | |
| SCHEMBL536696 | 0.76 | MAPK1 (0.62) | USP2HPGDTSHRMAPK1ALDH1A1 | |
| SCHEMBL4413055 | 0.72 | HPGD (0.60) | ASAH1HPGDMAPK1 | |
| SCHEMBL9715926 | 0.71 | CBX7 (0.47) | ASAH1USP2HPGDTSHRMAPK1 | |
| SCHEMBL9715990 | 0.71 | NPC1 (0.57) | ASAH1USP2HPGDTSHRMAPK1 | |
| SCHEMBL29460879 | 0.70 | NPC1 (0.42) | ASAH1 | |
| SCHEMBL16475228 | 0.70 | NPC1 (0.42) | ASAH1 | |
| SCHEMBL9715959 | 0.69 | POLB (0.33) | TSHRMAPK1ALDH1A1MIF |
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 |
|---|---|---|---|---|---|---|---|
| US-5102898-A | Halosubstituted alkyne group; fungicides | ROHM AND HAAS COMPANY (US) | 1992-04-07 | — | — | US | disclosed |