Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | KISS1R | Q969F8 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.33 |
| ▸ | KDM4A | O75164 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | PAOX | Q6QHF9 | 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 | |
|---|---|---|---|---|
| SCHEMBL23279210 | 1.00 | EPHX1 (0.46) | EPHX1KISS1RTRPV1TRPA1ALDH1A1 | |
| SCHEMBL10870418 | 1.00 | EPHX1 (0.46) | EPHX1KISS1RTRPV1TRPA1ALDH1A1 | |
| SCHEMBL7908941 | 1.00 | EPHX1 (0.46) | EPHX1KISS1RTRPV1TRPA1ALDH1A1 | |
| SCHEMBL19921552 | 0.97 | — | — | |
| SCHEMBL27273014 | 0.97 | — | — | |
| SCHEMBL1338093 | 0.90 | — | — | |
| SCHEMBL6285447 | 0.81 | TRPV1 (0.50) | TRPV1TRPA1ALDH1A1MAPTSPHK1 | |
| SCHEMBL5136479 | 0.81 | TRPV1 (0.50) | TRPV1TRPA1ALDH1A1MAPTSPHK1 | |
| SCHEMBL4443550 | 0.81 | TRPV1 (0.50) | TRPV1TRPA1ALDH1A1MAPTSPHK1 | |
| SCHEMBL7757768 | 0.81 | TRPV1 (0.50) | TRPV1TRPA1ALDH1A1MAPTSPHK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |