Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | PIK3C2B | O00750 | 1/20 | 0.37 |
| ▸ | PIK3C2G | O75747 | 1/20 | 0.37 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 2/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.36 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL24309292 | 1.00 | TSHR (0.39) | TSHRSMN1; SMN2POLBCA12CA1 | |
| SCHEMBL26807167 | 0.92 | MAPT (0.45) | TSHRSMN1; SMN2POLBCA12CA1 | |
| SCHEMBL24309603 | 0.91 | POLB (0.45) | TSHRSMN1; SMN2POLBCA12CA1 | |
| SCHEMBL26807160 | 0.88 | CA12 (0.41) | TSHRSMN1; SMN2POLBCA12CA1 | |
| SCHEMBL26807174 | 0.88 | CA12 (0.39) | TSHRSMN1; SMN2POLBCA12CA1 | |
| SCHEMBL26807176 | 0.88 | PLA2G7 (0.46) | SMN1; SMN2POLBCA12CA1CA2 | |
| SCHEMBL24309286 | 0.86 | PGR (0.48) | MAPTALDH1A1PGRLMNATDP1 | |
| SCHEMBL29566653 | 0.86 | PGR (0.48) | MAPTALDH1A1PGRLMNATDP1 | |
| SCHEMBL26807170 | 0.86 | SMN1; SMN2 (0.37) | TSHRSMN1; SMN2POLBCA12CA1 | |
| SCHEMBL26807163 | 0.85 | SMN1; SMN2 (0.40) | TSHRSMN1; SMN2POLBCA12CA1 |
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 |