Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | SCN4A | P35499 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 4/20 | 0.32 |
| ▸ | CA2 | P00918 | 4/20 | 0.32 |
| ▸ | CA4 | P22748 | 4/20 | 0.32 |
| ▸ | CA9 | Q16790 | 4/20 | 0.32 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.31 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | DRD4 | P21917 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL24325747 | 1.00 | MEN1 (0.33) | MEN1KMT2ALMNATSHRMAPK1 | |
| SCHEMBL24325424 | 0.88 | SMO (0.33) | — | |
| SCHEMBL24326673 | 0.87 | ALDH1A1 (0.40) | MEN1KMT2ALMNAMAPK1SCN4A | |
| SCHEMBL24326333 | 0.86 | ALDH1A1 (0.40) | MEN1KMT2ALMNATSHRMAPK1 | |
| SCHEMBL29570523 | 0.86 | ALDH1A1 (0.40) | MEN1KMT2ALMNATSHRMAPK1 | |
| SCHEMBL29570636 | 0.86 | ALDH1A1 (0.40) | MEN1KMT2ALMNATSHRMAPK1 | |
| SCHEMBL24326312 | 0.86 | ALDH1A1 (0.40) | MEN1KMT2ALMNATSHRMAPK1 | |
| SCHEMBL24325753 | 0.86 | ALDH1A1 (0.40) | MEN1KMT2ALMNATSHRMAPK1 | |
| SCHEMBL29570936 | 0.86 | ALDH1A1 (0.40) | MEN1KMT2ALMNATSHRMAPK1 | |
| SCHEMBL24326262 | 0.86 | ROCK2 (0.34) | — |
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-2022076625-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |