Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 3/20 | 0.48 |
| ▸ | LY96 | Q9Y6Y9 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9967788 | 1.00 | HSD11B1 (0.48) | HSD11B1LY96BCHEDHODHKMT2A | |
| SCHEMBL24309281 | 1.00 | HSD11B1 (0.48) | HSD11B1LY96BCHEDHODHKMT2A | |
| SCHEMBL8900317 | 0.78 | HSD11B1 (0.62) | HSD11B1LY96BCHEKMT2AMEN1 | |
| SCHEMBL297691 | 0.78 | HSD11B1 (0.62) | HSD11B1LY96BCHEKMT2AMEN1 | |
| SCHEMBL1751871 | 0.78 | HSD11B1 (0.62) | HSD11B1LY96BCHEKMT2AMEN1 | |
| SCHEMBL31613215 | 0.78 | HSD11B1 (0.62) | HSD11B1LY96BCHEKMT2AMEN1 | |
| SCHEMBL18243722 | 0.77 | HSD11B1 (0.42) | HSD11B1LY96BCHEKMT2AMEN1 | |
| SCHEMBL6873626 | 0.76 | DHODH (0.38) | DHODHKMT2AMEN1ALDH1A1CYP3A4 | |
| SCHEMBL18191762 | 0.76 | ALDH1A1 (0.48) | DHODHKMT2AMEN1ALDH1A1NPC1 | |
| SCHEMBL265503 | 0.75 | HSD11B1 (0.54) | HSD11B1LY96BCHEKMT2AMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4225748-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |