Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | OGFRL1 | Q5TC84 | 8/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 6/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 4/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31037915 | 0.77 | GRM2 (0.38) | OPRM1OPRL1TGFBR1KDRMAPK14 | |
| SCHEMBL31037902 | 0.77 | GRM2 (0.38) | OPRM1OPRL1TGFBR1KDRMAPK14 | |
| SCHEMBL31037920 | 0.77 | TGFBR1 (0.39) | TGFBR1KDRMAPK14 | |
| SCHEMBL31546233 | 0.77 | TGFBR1 (0.39) | TGFBR1KDRMAPK14 | |
| SCHEMBL31037922 | 0.74 | GRM2 (0.42) | ALDH1A1TGFBR1KDRMAPK14CNR2 | |
| SCHEMBL31037903 | 0.74 | GRM2 (0.42) | ALDH1A1TGFBR1KDRMAPK14CNR2 | |
| SCHEMBL17572863 | 0.70 | BRD4 (0.42) | — | |
| SCHEMBL1500383 | 0.63 | ALDH1A1 (0.50) | ALDH1A1POLBKEAP1NFE2L2 | |
| SCHEMBL6922941 | 0.63 | PARP1 (0.46) | PARP1ALDH1A1 | |
| SCHEMBL2616547 | 0.63 | HCAR3 (0.53) | ALDH1A1OGFRL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118666851-A | Condensed ring KIF18A inhibitor compound, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2024-09-20 | — | — | CN | disclosed |