Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | S1PR4 | O95977 | 6/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | GRIK1 | P39086 | 3/20 | 0.40 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27331219 | 0.92 | MAPT (0.51) | MAPTTP53BLMS1PR4NPC1 | |
| SCHEMBL27328699 | 0.91 | MAPT (0.49) | MAPTTP53BLMS1PR4NPC1 | |
| SCHEMBL27331226 | 0.89 | MAPT (0.49) | MAPTTP53BLMS1PR4NPC1 | |
| SCHEMBL27328676 | 0.89 | MAPT (0.49) | MAPTTP53BLMS1PR4NPC1 | |
| SCHEMBL27329641 | 0.89 | MAPT (0.49) | MAPTTP53BLMS1PR4NPC1 | |
| SCHEMBL27328909 | 0.88 | MAPT (0.45) | MAPTTP53BLMS1PR4NPC1 | |
| SCHEMBL27328954 | 0.88 | ALDH1A1 (0.42) | MAPTTP53BLMS1PR4KDM4E | |
| SCHEMBL27328698 | 0.88 | MAPT (0.47) | MAPTTP53BLMS1PR4NPC1 | |
| SCHEMBL27328691 | 0.88 | MAPT (0.47) | MAPTTP53BLMS1PR4NPC1 | |
| SCHEMBL27331224 | 0.87 | MAPT (0.51) | MAPTTP53BLMS1PR4NPC1 |
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-2024103400-A1 | POLYCYCLIC COMPOUND AS GPR75 ACTIVATOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF | 水木未来(北京)科技有限公司 | 2024-05-23 | — | — | WO | disclosed |