Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.42 |
| ▸ | KDR | P35968 | 2/20 | 0.42 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 2/20 | 0.33 |
| ▸ | JAK1 | P23458 | 2/20 | 0.33 |
| ▸ | TYK2 | P29597 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23747149 | 0.85 | PTGS1 (0.35) | BRAFPTGS1PTGS2CHRNA7HTR3A | |
| SCHEMBL23746986 | 0.85 | EGFR (0.44) | EGFRKDRBRAFPTGS1CHRNA7 | |
| SCHEMBL23747097 | 0.77 | KDM4E (0.47) | EGFRKDR | |
| SCHEMBL23747100 | 0.74 | EGFR (0.43) | EGFRKDRCHRNA7HTR3A | |
| SCHEMBL23746993 | 0.73 | FFAR4 (0.50) | EGFRKDR | |
| SCHEMBL23747098 | 0.73 | ALDH1A1 (0.49) | EGFRKDR | |
| SCHEMBL23746994 | 0.73 | EGFR (0.45) | EGFRKDR | |
| SCHEMBL23747216 | 0.71 | EDNRB (0.40) | EGFRKDRBRAFCHRNA7HTR3A | |
| SCHEMBL23746995 | 0.71 | FKBP1A (0.43) | EGFRKDRCHRNA7HTR3A | |
| SCHEMBL23746997 | 0.70 | EGFR (0.43) | EGFRKDRBRAFCHRNA7HTR3A |
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-2021158516-A1 | IRE1α MODULATORS AND USES THEREOF | NIMBUS IASO, INC. (US) | 2021-08-12 | — | — | WO | disclosed |