Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TRPV3 | Q8NET8 | 11/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28175534 | 0.82 | PIK3CA (0.44) | TRPV3KCNH2PIK3CACYP2C19TRPV4 | |
| SCHEMBL16538500 | 0.80 | KCNH2 (0.42) | LMNATRPV3KCNH2POLBPIK3CA | |
| SCHEMBL28074496 | 0.80 | KCNH2 (0.42) | TRPV3KCNH2PIK3CAPDE10ATRPV4 | |
| SCHEMBL990141 | 0.80 | TRPV3 (0.46) | TRPV3KCNH2PIK3CAPDE10ACYP2C19 | |
| SCHEMBL16538788 | 0.79 | KCNH2 (0.53) | KDM4ELMNATRPV3KCNH2ALDH1A1 | |
| SCHEMBL15888381 | 0.78 | KDM4E (0.54) | KDM4ELMNATRPV3ALDH1A1POLB | |
| SCHEMBL31301320 | 0.78 | KDM4E (0.54) | KDM4ELMNATRPV3ALDH1A1POLB | |
| SCHEMBL15223276 | 0.78 | KDM4E (0.53) | KDM4ELMNAALDH1A1POLBPIK3CA | |
| SCHEMBL17247907 | 0.77 | CYP2A6 (0.53) | TRPV3KCNH2PIK3CATRPV4 | |
| SCHEMBL12538145 | 0.77 | TRPV3 (0.54) | TRPV3KCNH2TRPV4 |
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-105612153-B | Substituted heterocyclic sulfonamide compound as TRPA1 conditioning agents | 豪夫迈·罗氏有限公司 | 2018-09-14 | — | — | CN | disclosed |