Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 4/20 | 0.47 |
| ▸ | EGFR | P00533 | 16/20 | 0.41 |
| ▸ | JAK2 | O60674 | 2/20 | 0.38 |
| ▸ | BLK | P51451 | 2/20 | 0.38 |
| ▸ | BMX | P51813 | 2/20 | 0.38 |
| ▸ | JAK3 | P52333 | 2/20 | 0.38 |
| ▸ | NUAK1 | O60285 | 2/20 | 0.37 |
| ▸ | NUAK2 | Q9H093 | 2/20 | 0.37 |
| ▸ | PLK4 | O00444 | 1/20 | 0.36 |
| ▸ | GAK | O14976 | 1/20 | 0.36 |
| ▸ | FLT3 | P36888 | 1/20 | 0.36 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.36 |
| ▸ | ITK | Q08881 | 1/20 | 0.36 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.36 |
| ▸ | DCLK3 | Q9C098 | 1/20 | 0.36 |
| ▸ | EML4 | Q9HC35 | 1/20 | 0.36 |
| ▸ | EIF2AK4 | Q9P2K8 | 1/20 | 0.36 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24309843 | 0.86 | CTSC (0.41) | CTSCEGFRJAK2JAK3PTK2 | |
| SCHEMBL24310413 | 0.85 | CTSC (0.35) | CTSCEGFRPTK2 | |
| SCHEMBL24309808 | 0.83 | CTSC (0.46) | CTSCEGFRJAK2BLKBMX | |
| SCHEMBL29566696 | 0.83 | CTSC (0.46) | CTSCEGFRJAK2BLKBMX | |
| SCHEMBL24309916 | 0.80 | EGFR (0.39) | CTSCEGFRJAK2BLKBMX | |
| SCHEMBL24310392 | 0.80 | MAP4K1 (0.35) | CTSCPTK2 | |
| SCHEMBL24310153 | 0.80 | CTSC (0.36) | CTSCEGFRJAK2BLKBMX | |
| SCHEMBL24309648 | 0.78 | CDK1 (0.34) | — | |
| SCHEMBL24310106 | 0.78 | DRD2 (0.34) | CTSCEGFRPTK2 | |
| SCHEMBL24310715 | 0.75 | CSF1R (0.35) | CTSCEGFRJAK2JAK3PTK2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |