Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 13/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 12/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL923510 | 1.00 | TRPV4 (0.52) | TRPV4ALDH1A1SMN1; SMN2CYP11B2CYP11B1 | |
| SCHEMBL7562408 | 0.86 | CYP11B2 (0.47) | TRPV4ALDH1A1SMN1; SMN2CYP11B2CYP11B1 | |
| SCHEMBL6061330 | 0.85 | KIF11 (0.54) | TRPV4CYP11B2CYP11B1 | |
| SCHEMBL48778 | 0.84 | PTP4A3 (0.49) | TRPV4ALDH1A1SMN1; SMN2EGFR | |
| SCHEMBL10613739 | 0.83 | TRPV4 (0.55) | TRPV4CYP11B2CYP11B1 | |
| SCHEMBL10613747 | 0.83 | TRPV4 (0.55) | TRPV4CYP11B2CYP11B1 | |
| SCHEMBL14661910 | 0.83 | AR (0.50) | TRPV4 | |
| SCHEMBL21676228 | 0.82 | TRPV4 (0.46) | TRPV4ALDH1A1CYP11B2CYP11B1 | |
| SCHEMBL28606434 | 0.82 | TRPV4 (0.53) | TRPV4CYP11B2CYP11B1 | |
| SCHEMBL4809997 | 0.81 | SLC22A12 (0.47) | TRPV4ALDH1A1SMN1; SMN2CYP11B2CYP11B1 |
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-114507227-A | Benzisothiazole compound, preparation method thereof, pharmaceutical composition and application | 中国医学科学院药物研究所 | 2022-05-17 | — | — | CN | disclosed |