Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 18/20 | 0.66 |
| ▸ | MAP2K2 | P36507 | 16/20 | 0.66 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | BRAF | P15056 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | ACTR3 | P61158 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CPS1 | P31327 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22453383 | 0.90 | MAP2K1 (0.76) | MAP2K1MAP2K2CHRM2CHRM1BRAF | |
| SCHEMBL18968395 | 0.81 | MAP2K1 (0.62) | MAP2K1MAP2K2CHRM2CHRM1BRAF | |
| SCHEMBL29413551 | 0.79 | MAP2K1 (1.00) | MAP2K1MAP2K2CHRM2CHRM1BRAF | |
| SCHEMBL189188 | 0.79 | MAP2K1 (1.00) | MAP2K1MAP2K2CHRM2CHRM1BRAF | |
| Hydrochloric Acid SCHEMBL29413470 | 0.78 | MAP2K1 (0.98) | MAP2K1MAP2K2CHRM2CHRM1BRAF | |
| SCHEMBL18968387 | 0.77 | MAP2K1 (0.58) | MAP2K1MAP2K2CHRM2CHRM1BRAF | |
| SCHEMBL18968425 | 0.76 | MAP2K1 (0.57) | MAP2K1MAP2K2CHRM2CHRM1BRAF | |
| SCHEMBL18968032 | 0.76 | MAP2K2 (0.57) | MAP2K1MAP2K2CHRM2CHRM1BRAF | |
| SCHEMBL23398087 | 0.76 | MAP2K2 (0.70) | MAP2K1MAP2K2CHRM2CHRM1BRAF | |
| SCHEMBL18968353 | 0.76 | MAP2K1 (0.56) | MAP2K1MAP2K2CHRM2CHRM1BRAF |
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-2021154929-A1 | COMBINATION THERAPY FOR TREATING ABNORMAL CELL GROWTH | VERASTEM, INC. (US) | 2021-08-05 | — | — | WO | disclosed |