Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.38 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
| ▸ | FPR2 | P25090 | 1/20 | 0.30 |
| ▸ | RIPK1 | Q13546 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24965167 | 0.88 | SMN1; SMN2 (0.40) | TSHRSMN1; SMN2NAALAD2ERAP1KDM4C | |
| SCHEMBL24965166 | 0.88 | SMN1; SMN2 (0.40) | TSHRSMN1; SMN2NAALAD2ERAP1KDM4C | |
| SCHEMBL24633806 | 0.84 | NAALAD2 (0.44) | NAALAD2KDM4C | |
| SCHEMBL24633802 | 0.82 | FPR2 (0.47) | SMN1; SMN2NAALAD2FPR2 | |
| SCHEMBL28959555 | 0.79 | TSHR (0.40) | TSHRSMN1; SMN2NAALAD2ERAP1KDM4C | |
| SCHEMBL24633811 | 0.79 | NAALAD2 (0.35) | NAALAD2 | |
| SCHEMBL29465191 | 0.78 | TSHR (0.39) | TSHRSMN1; SMN2NAALAD2KDM4C | |
| SCHEMBL19199689 | 0.76 | KDM4E (0.42) | — | |
| SCHEMBL13544391 | 0.76 | NAALAD2 (0.47) | TSHRSMN1; SMN2NAALAD2ERAP1KDM4C | |
| SCHEMBL5607969 | 0.76 | NAALAD2 (0.47) | TSHRSMN1; SMN2NAALAD2ERAP1KDM4C |
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-2022234853-A1 | CYCLIC COMPOUND HAVING INHIBITORY EFFECT SELECTIVE FOR KRAS BUT NOT FOR HRAS AND NRAS | 中外製薬株式会社 | 2022-11-10 | — | — | WO | disclosed |