Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 2/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 4/20 | 0.33 |
| ▸ | HTR7 | P34969 | 4/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.33 |
| ▸ | KDR | P35968 | 2/20 | 0.33 |
| ▸ | SLC8A1 | P32418 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 2/20 | 0.31 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24310138 | 1.00 | TSHR (0.35) | TSHRSMN1; SMN2BRD4PIK3CDPIK3CB | |
| SCHEMBL26810238 | 0.89 | SMN1; SMN2 (0.38) | TSHRSMN1; SMN2BRD4PIK3CDPIK3CB | |
| SCHEMBL29566612 | 0.89 | TSHR (0.43) | TSHRSMN1; SMN2BRD4PIK3CDPIK3CB | |
| SCHEMBL24310345 | 0.89 | TSHR (0.43) | TSHRSMN1; SMN2BRD4PIK3CDPIK3CB | |
| SCHEMBL29566748 | 0.88 | GAA (0.40) | TSHRSMN1; SMN2BRD4PIK3CDPIK3CB | |
| SCHEMBL24310086 | 0.88 | GAA (0.40) | TSHRSMN1; SMN2BRD4PIK3CDPIK3CB | |
| SCHEMBL26810218 | 0.88 | KMT2A (0.40) | TSHRSMN1; SMN2EGFRFGFR1KDR | |
| SCHEMBL24310136 | 0.88 | TSHR (0.33) | TSHRSMN1; SMN2BRD4PIK3CDPIK3CB | |
| SCHEMBL29566661 | 0.88 | TSHR (0.33) | TSHRSMN1; SMN2BRD4PIK3CDPIK3CB | |
| SCHEMBL26857058 | 0.88 | TSHR (0.36) | TSHRSMN1; SMN2BRD4PIK3CDPIK3CB |
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 |