Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.48 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24287750 | 1.00 | TSHR (0.56) | TSHRSMN1; SMN2GAAPKMFFAR4 | |
| SCHEMBL24287513 | 0.80 | TSHR (0.48) | TSHRSMN1; SMN2GAAPKMFFAR4 | |
| SCHEMBL29516231 | 0.80 | TSHR (0.48) | TSHRSMN1; SMN2GAAPKMFFAR4 | |
| SCHEMBL29516442 | 0.80 | KDM4E (0.48) | TSHRGAAPKMFFAR4KDM4E | |
| SCHEMBL24287719 | 0.80 | KDM4E (0.48) | TSHRGAAPKMFFAR4KDM4E | |
| SCHEMBL24287288 | 0.77 | KDM4E (0.50) | TSHRGAAPKMFFAR4KDM4E | |
| SCHEMBL29516427 | 0.77 | KDM4E (0.50) | TSHRGAAPKMFFAR4KDM4E | |
| SCHEMBL26810905 | 0.74 | SMN1; SMN2 (0.54) | TSHRSMN1; SMN2GAAPKMFFAR4 | |
| SCHEMBL26797294 | 0.74 | FFAR4 (0.54) | TSHRGAAPKMFFAR4KDM4E | |
| SCHEMBL24287271 | 0.74 | KDM4E (0.59) | TSHRSMN1; SMN2GAAPKMMEN1 |
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-4225750-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022076629-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |