Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 1/20 | 0.44 |
| ▸ | SUV39H2 | Q9H5I1 | 7/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.43 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 3/20 | 0.43 |
| ▸ | SMPD3 | Q9NY59 | 2/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | PGK1 | P00558 | 1/20 | 0.41 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.40 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.40 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.40 |
| ▸ | CACNG3 | O60359 | 1/20 | 0.40 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.40 |
| ▸ | CACNA1H | O95180 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30622947 | 1.00 | CFTR (0.44) | CFTRSUV39H2MEN1KMT2AALDH1A1 | |
| SCHEMBL26645025 | 0.88 | CFTR (0.44) | CFTRMEN1KMT2AALDH1A1GRM5 | |
| SCHEMBL30622995 | 0.88 | CFTR (0.44) | CFTRMEN1KMT2AALDH1A1GRM5 | |
| SCHEMBL26645489 | 0.86 | MEN1 (0.44) | MEN1KMT2AGRM5NR1H2 | |
| SCHEMBL26645578 | 0.85 | GRM5 (0.50) | MEN1KMT2AGRM5NR1H2CACNB4 | |
| SCHEMBL26645758 | 0.85 | GRM5 (0.43) | MEN1KMT2AGRM5NR1H2 | |
| SCHEMBL26645030 | 0.84 | HTT (0.55) | MEN1KMT2AALDH1A1GRM5NR1H2 | |
| SCHEMBL26645772 | 0.82 | GRM5 (0.51) | MEN1KMT2AALDH1A1GRM5NR1H2 | |
| SCHEMBL16711314 | 0.81 | GRM5 (0.50) | GRM5NR1H2HTT | |
| SCHEMBL30623007 | 0.81 | MEN1 (0.41) | MEN1KMT2AGRM5NR1H2 |
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 |