Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.42 |
| ▸ | HEXA | P06865 | 1/20 | 0.42 |
| ▸ | HEXB | P07686 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.40 |
| ▸ | GCGR | P47871 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CDK8 | P49336 | 1/20 | 0.37 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.36 |
| ▸ | FABP3 | P05413 | 1/20 | 0.36 |
| ▸ | FABP4 | P15090 | 1/20 | 0.36 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23399929 | 0.87 | PDE5A (0.45) | MAPTRECQLGCGRPOLBKDM4E | |
| SCHEMBL23399022 | 0.85 | HEXA (0.44) | HEXAHEXBMAPTGCGRPOLB | |
| SCHEMBL23400391 | 0.84 | HSD11B1 (0.43) | DHFRMAPTRECQLGCGRKDM4E | |
| SCHEMBL23398438 | 0.82 | DHFR (0.43) | DHFRHEXAHEXBMAPTESR1 | |
| SCHEMBL23399319 | 0.81 | DHFR (0.45) | DHFRHEXAHEXBMAPTESR1 | |
| SCHEMBL23401154 | 0.80 | MAPT (0.62) | MAPTPOLBCDK8ACVR1KDM4E | |
| SCHEMBL23398516 | 0.80 | ALDH1A1 (0.49) | DHFRHEXAHEXBMAPTGAA | |
| SCHEMBL11942140 | 0.79 | DHFR (0.42) | DHFRHEXAHEXBMAPTRECQL | |
| SCHEMBL23401797 | 0.79 | SMN1; SMN2 (0.45) | DHFRHEXAHEXBMAPTESR1 | |
| SCHEMBL17290362 | 0.77 | TP53 (0.51) | MAPTRECQLPOLBCDK8KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3828159-A1 | STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS | BASF SE (DE) | 2021-06-02 | — | — | EP | disclosed |