Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.33 |
| ▸ | GLP1R | P43220 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12127970 | 0.82 | TRPM8 (0.39) | TRPM8TDP1GAAMEN1KMT2A | |
| SCHEMBL12411085 | 0.80 | MEN1 (0.44) | TRPM8TDP1GAAPOLBMEN1 | |
| SCHEMBL10037144 | 0.79 | NOS3 (0.59) | TRPM8NOS3NOS2MEN1KMT2A | |
| SCHEMBL28464340 | 0.78 | MEN1 (0.38) | TRPM8TDP1GAAMEN1KMT2A | |
| SCHEMBL1748325 | 0.78 | GAA (0.48) | TRPM8TDP1GAAPOLBMEN1 | |
| SCHEMBL13116022 | 0.77 | NOS3 (0.61) | GAAPOLBNOS3NOS2ALDH1A1 | |
| SCHEMBL30689573 | 0.77 | NOS3 (0.61) | GAAPOLBNOS3NOS2ALDH1A1 | |
| SCHEMBL9493382 | 0.76 | GAA (0.52) | TRPM8TDP1GAAPOLBMEN1 | |
| SCHEMBL1335228 | 0.76 | ABCB1 (0.45) | TRPM8TDP1GAAMEN1KMT2A | |
| SCHEMBL25867761 | 0.76 | TRPM8 (0.39) | TRPM8TDP1GAAPOLBMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9725440-B2 | Modulators of CFTR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2017-08-08 | — | — | US | disclosed |