Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12076189 | 0.83 | — | — | |
| SCHEMBL29163406 | 0.82 | NPC1 (0.38) | SMN1; SMN2 | |
| SCHEMBL28186501 | 0.82 | — | — | |
| SCHEMBL29163495 | 0.81 | NPC1 (0.37) | SMN1; SMN2 | |
| SCHEMBL5050049 | 0.80 | — | — | |
| SCHEMBL27618213 | 0.79 | — | — | |
| SCHEMBL28387709 | 0.78 | MMP3 (0.37) | MAPTKMT2A | |
| Sulfuric Acid SCHEMBL28113878 | 0.78 | — | — | |
| SCHEMBL28384769 | 0.77 | MMP3 (0.36) | MAPTKMT2A | |
| SCHEMBL28089246 | 0.77 | BCL2L1 (0.33) | TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-110731961-A | Metal organic framework, pharmaceutical preparation and use thereof in preparing medicament | 芝加哥大学 | 2020-01-31 | — | — | CN | disclosed |