Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20673887 | 0.76 | KMT2A (0.33) | — | |
| SCHEMBL5174008 | 0.71 | NTRK1 (0.32) | — | |
| SCHEMBL20631042 | 0.71 | GAA (0.32) | GAA | |
| SCHEMBL21958627 | 0.70 | CA2 (0.34) | CA2 | |
| SCHEMBL20674023 | 0.67 | CA2 (0.41) | CA2GAAKDM4EALDH1A1 | |
| SCHEMBL21955856 | 0.67 | MEN1 (0.46) | GAAALDH1A1 | |
| SCHEMBL20631034 | 0.67 | — | — | |
| SCHEMBL20631059 | 0.66 | KDM4E (0.35) | KDM4EALDH1A1 | |
| SCHEMBL21958543 | 0.66 | CNOT7 (0.30) | CA2 | |
| SCHEMBL20631027 | 0.66 | FEN1 (0.30) | — |
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-2019010295-A1 | SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE | CS PHARMATECH LIMITED (KY) | 2019-01-10 | — | — | WO | disclosed |