Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | CA1 | P00915 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
| ▸ | MMP1 | P03956 | 1/20 | 0.57 |
| ▸ | MMP2 | P08253 | 1/20 | 0.57 |
| ▸ | MMP9 | P14780 | 1/20 | 0.57 |
| ▸ | MMP8 | P22894 | 1/20 | 0.57 |
| ▸ | MMP13 | P45452 | 1/20 | 0.57 |
| ▸ | FBP1 | P09467 | 1/20 | 0.57 |
| ▸ | KDM1A | O60341 | 2/20 | 0.56 |
| ▸ | DDX3X | O00571 | 1/20 | 0.55 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.54 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | EDNRA | P25101 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL24298639 | 1.00 | ALDH1A1 (0.60) | ALDH1A1LMNAKMT2AMEN1CA1 | |
| SCHEMBL29566554 | 0.87 | PGR (0.64) | ALDH1A1LMNAKMT2AMEN1CA1 | |
| SCHEMBL24309294 | 0.87 | PGR (0.64) | ALDH1A1LMNAKMT2AMEN1CA1 | |
| SCHEMBL29457779 | 0.86 | LMNA (0.55) | ALDH1A1LMNAKMT2AMEN1CA1 | |
| SCHEMBL24330660 | 0.86 | LMNA (0.55) | ALDH1A1LMNAKMT2AMEN1CA1 | |
| SCHEMBL26868831 | 0.84 | LMNA (0.57) | ALDH1A1LMNAKMT2AMEN1CA1 | |
| SCHEMBL24309251 | 0.84 | LMNA (0.52) | ALDH1A1LMNAKMT2AMEN1FBP1 | |
| SCHEMBL29566909 | 0.84 | LMNA (0.52) | ALDH1A1LMNAKMT2AMEN1FBP1 | |
| SCHEMBL29566547 | 0.83 | LMNA (0.51) | ALDH1A1LMNAKMT2AMEN1CA1 | |
| SCHEMBL24309308 | 0.83 | LMNA (0.51) | ALDH1A1LMNAKMT2AMEN1CA1 |
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 |