Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.48 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.47 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.47 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | KDM1A | O60341 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | IL1RN | P18510 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24309359 | 1.00 | TSHR (0.50) | TSHRNPSR1KDM4ERXFP1PIK3CD | |
| SCHEMBL24309362 | 0.79 | PGR (0.47) | TSHRNPSR1KDM4EMAPTMEN1 | |
| SCHEMBL29567205 | 0.79 | PGR (0.47) | TSHRNPSR1KDM4EMAPTMEN1 | |
| SCHEMBL24310041 | 0.78 | TSHR (0.58) | TSHRNPSR1KDM4EMAPTMEN1 | |
| SCHEMBL24309401 | 0.77 | TSHR (0.66) | TSHRNPSR1KDM4ERXFP1MEN1 | |
| SCHEMBL24310050 | 0.75 | TSHR (0.59) | TSHRNPSR1KDM4EMAPTGAA | |
| SCHEMBL10643363 | 0.75 | TSHR (0.62) | TSHRNPSR1KDM4ERXFP1MAPT | |
| SCHEMBL26812357 | 0.75 | EDNRA (0.47) | TSHRNPSR1KDM4EMAPTMEN1 | |
| SCHEMBL24310040 | 0.75 | TSHR (0.58) | TSHRNPSR1KDM4ERXFP1MAPT | |
| SCHEMBL29516515 | 0.75 | KDM4E (0.59) | TSHRNPSR1KDM4ERXFP1MAPT |
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 |