Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 6/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | LIPE | Q05469 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | SCN10A | Q9Y5Y9 | 5/20 | 0.35 |
| ▸ | SCN8A | Q9UQD0 | 4/20 | 0.35 |
| ▸ | TRPV3 | Q8NET8 | 2/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.33 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.33 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.33 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.33 |
| ▸ | FPR2 | P25090 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15750456 | 0.92 | TRPV4 (0.47) | TRPV4SCN9AMRGPRX4LIPECHRNB2 | |
| SCHEMBL29630954 | 0.92 | TRPV4 (0.47) | TRPV4SCN9AMRGPRX4LIPECHRNB2 | |
| SCHEMBL29040447 | 0.79 | — | — | |
| SCHEMBL29267535 | 0.75 | TRPV1 (0.40) | — | |
| SCHEMBL29092844 | 0.73 | — | — | |
| SCHEMBL929327 | 0.72 | TRPV4 (0.52) | TRPV4SCN9AMRGPRX4CHRNB2CHRNA4 | |
| SCHEMBL28469794 | 0.71 | HDAC1 (0.32) | — | |
| SCHEMBL31130640 | 0.71 | TRPV4 (0.50) | TRPV4SCN9AMRGPRX4LIPECHRNB2 | |
| SCHEMBL29222009 | 0.71 | ORAI1 (0.37) | — | |
| SCHEMBL26750074 | 0.70 | CHRNB2 (0.49) | TRPV4SCN9AMRGPRX4LIPECHRNB2 |
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-113330001-B | 3, 3-Difluoroallylamine or salt thereof and pharmaceutical composition comprising the same | 柳韩洋行 | 2024-07-02 | — | — | CN | disclosed |