Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 18/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL28188978 | 0.87 | KCNN4 (0.39) | KCNN4ALDH1A1 | |
| SCHEMBL28188992 | 0.87 | KCNN4 (0.50) | KCNN4 | |
| SCHEMBL28458370 | 0.84 | P2RX7 (0.42) | KCNN4 | |
| SCHEMBL28189014 | 0.83 | ALDH1A1 (0.53) | KCNN4ALDH1A1TSHR | |
| SCHEMBL28189001 | 0.82 | ALDH1A1 (0.46) | KCNN4ALDH1A1TSHR | |
| SCHEMBL28188353 | 0.79 | ALDH1A1 (0.55) | KCNN4ALDH1A1TSHR | |
| SCHEMBL1493508 | 0.76 | KCNN4 (0.44) | KCNN4ALDH1A1TSHR | |
| SCHEMBL28461340 | 0.76 | KCNN4 (0.48) | KCNN4ALDH1A1TSHR | |
| SCHEMBL28455981 | 0.75 | NPC1 (0.44) | KCNN4ALDH1A1 | |
| SCHEMBL28461418 | 0.75 | TP53 (0.36) | KCNN4ALDH1A1 |
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-107501198-B | Sulfoxide tetrazole derivative and preparation method and application thereof | 南京农业大学 | 2020-08-18 | — | — | CN | claimed |
| CN-107501198-B | Sulfoxide tetrazole derivative and preparation method and application thereof | 南京农业大学 | 2020-08-18 | — | — | CN | disclosed |