Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SUV39H2 | Q9H5I1 | 6/20 | 0.44 |
| ▸ | CFTR | P13569 | 2/20 | 0.42 |
| ▸ | PGK1 | P00558 | 1/20 | 0.41 |
| ▸ | SMPD3 | Q9NY59 | 2/20 | 0.40 |
| ▸ | CACNB4 | O00305 | 2/20 | 0.40 |
| ▸ | CACNA1A | O00555 | 2/20 | 0.40 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.40 |
| ▸ | CACNG3 | O60359 | 2/20 | 0.40 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.40 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.40 |
| ▸ | CACNB3 | P54284 | 2/20 | 0.40 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.40 |
| ▸ | CACNG7 | P62955 | 2/20 | 0.40 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.40 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.40 |
| ▸ | CACNB1 | Q02641 | 2/20 | 0.40 |
| ▸ | CACNG1 | Q06432 | 2/20 | 0.40 |
| ▸ | CACNB2 | Q08289 | 2/20 | 0.40 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.40 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30622957 | 1.00 | SUV39H2 (0.44) | SUV39H2CFTRPGK1SMPD3CACNB4 | |
| SCHEMBL26645586 | 0.89 | CSNK1E (0.44) | CFTRSMPD3CSNK1EALKPIK3CD | |
| SCHEMBL30623018 | 0.89 | CSNK1E (0.44) | CFTRSMPD3CSNK1EALKPIK3CD | |
| SCHEMBL26645364 | 0.86 | CSNK1E (0.45) | CSNK1ECNR1CNR2 | |
| SCHEMBL30622740 | 0.85 | CFTR (0.42) | SUV39H2CFTRPGK1SMPD3CACNB4 | |
| SCHEMBL26645587 | 0.85 | CFTR (0.42) | SUV39H2CFTRPGK1SMPD3CACNB4 | |
| SCHEMBL26645223 | 0.84 | ALDH1A1 (0.48) | MEN1ALDH1A1KMT2ACSNK1EMAPT | |
| SCHEMBL16711450 | 0.81 | CSNK1E (0.52) | MEN1KMT2ACSNK1E | |
| SCHEMBL26645023 | 0.81 | MERTK (0.43) | SUV39H2CACNB4CACNA1ACACNA1GCACNG3 | |
| SCHEMBL30622947 | 0.80 | CFTR (0.44) | SUV39H2CFTRPGK1SMPD3CACNB4 |
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-2023213882-A1 | IRREVERSIBLE MUTEGFR INHIBITORS | BAYER AKTIENGESELLSCHAFT (DE) | 2023-11-09 | — | — | WO | disclosed |