Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.41 |
| ▸ | FABP4 | P15090 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
| ▸ | PCTP | Q9UKL6 | 1/20 | 0.38 |
| ▸ | WDR5 | P61964 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.38 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24309280 | 1.00 | TSHR (0.46) | TSHRSMN1; SMN2KDM4ELMNAALDH1A1 | |
| SCHEMBL24310316 | 0.94 | TSHR (0.45) | TSHRSMN1; SMN2KDM4ELMNAALDH1A1 | |
| SCHEMBL29566632 | 0.94 | TSHR (0.45) | TSHRSMN1; SMN2KDM4ELMNAALDH1A1 | |
| SCHEMBL29566650 | 0.93 | FABP4 (0.40) | TSHRSMN1; SMN2KDM4ELMNAALDH1A1 | |
| SCHEMBL24310281 | 0.93 | FABP4 (0.40) | TSHRSMN1; SMN2KDM4ELMNAALDH1A1 | |
| SCHEMBL24309276 | 0.92 | TSHR (0.44) | TSHRSMN1; SMN2LMNAGAAPKM | |
| SCHEMBL29567146 | 0.92 | TSHR (0.44) | TSHRSMN1; SMN2LMNAGAAPKM | |
| SCHEMBL26807185 | 0.87 | TSHR (0.39) | TSHRSMN1; SMN2LMNAGAAPKM | |
| SCHEMBL29566728 | 0.86 | SRC (0.43) | TSHRSMN1; SMN2LMNAALDH1A1GAA | |
| SCHEMBL29515241 | 0.84 | TSHR (0.41) | TSHRSMN1; SMN2ALDH1A1KMT2AMEN1 |
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 |