Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | BCL2 | P10415 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL10613331 | 0.77 | TP53 (0.41) | ALDH1A1MAPTHTTSMN1; SMN2 | |
| SCHEMBL14740720 | 0.77 | CALM1 (0.44) | ALDH1A1TRPA1TSHRBCL2MAPT | |
| SCHEMBL14802086 | 0.71 | KCNH2 (0.50) | TSHRMAPTHTTSMN1; SMN2 | |
| SCHEMBL28364344 | 0.70 | BCL2 (0.63) | ALDH1A1BCL2MAPTHTTSMN1; SMN2 | |
| SCHEMBL5814778 | 0.70 | KCNH2 (0.53) | TSHRMAPTHTTSMN1; SMN2 | |
| SCHEMBL5299903 | 0.70 | KCNH2 (0.53) | TSHRMAPTHTTSMN1; SMN2 | |
| SCHEMBL28647625 | 0.69 | NPC1 (0.40) | ALDH1A1MAPTSMN1; SMN2TDP1 | |
| Hydrochloric Acid SCHEMBL10764692 | 0.67 | TRPA1 (0.33) | ALDH1A1TRPA1TSHR | |
| SCHEMBL1263770 | 0.65 | SMN1; SMN2 (0.48) | ALDH1A1TSHRBCL2MAPTHTT | |
| SCHEMBL16469706 | 0.65 | MAPT (0.35) | TSHRBCL2MAPTHTTSMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112011098-B | Supermolecule luminescent gel system constructed by sulfonated cyclodextrin-bromophenyl picolinate-amino clay and preparation method thereof | 南开大学 | 2022-04-29 | — | — | CN | claimed |
| CN-112011098-A | Supermolecule luminescent gel system constructed by sulfonated cyclodextrin-bromophenyl picolinate-amino clay and preparation method thereof | 南开大学 | 2020-12-01 | — | — | CN | claimed |