Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | BTK | Q06187 | 4/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | FGFR2 | P21802 | 4/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.38 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.38 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CDK7 | P50613 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | CDK14 | O94921 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18909618 | 1.00 | JAK3 (0.43) | JAK3ALDH1A1NPC1HPGDRAB9A | |
| SCHEMBL27451749 | 1.00 | JAK3 (0.43) | JAK3ALDH1A1NPC1HPGDRAB9A | |
| SCHEMBL18904853 | 1.00 | JAK3 (0.43) | JAK3ALDH1A1NPC1HPGDRAB9A | |
| SCHEMBL19353252 | 0.92 | ALDH1A1 (0.51) | JAK3ALDH1A1NPC1HPGDRAB9A | |
| SCHEMBL10241495 | 0.92 | ALDH1A1 (0.51) | JAK3ALDH1A1NPC1HPGDRAB9A | |
| SCHEMBL10283866 | 0.92 | ALDH1A1 (0.51) | JAK3ALDH1A1NPC1HPGDRAB9A | |
| SCHEMBL27451704 | 0.92 | ALDH1A1 (0.51) | JAK3ALDH1A1NPC1HPGDRAB9A | |
| SCHEMBL24348777 | 0.91 | ALDH1A1 (0.47) | JAK3ALDH1A1NPC1HPGDRAB9A | |
| SCHEMBL462207 | 0.90 | ALDH1A1 (0.44) | JAK3ALDH1A1NPC1HPGDBTK | |
| SCHEMBL18909668 | 0.88 | CHRNB2 (0.38) | JAK3ALDH1A1HPGDBTKEGFR |
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-2021121390-A1 | HETEROCYCLIC COMPOUND, AND PHARMACEUTICAL COMPOSITION THEREOF, PREPARATION METHOD THEREFOR, INTERMEDIATE THEREOF AND APPLICATION THEREOF | 苏州信诺维医药科技股份有限公司 | 2021-06-24 | — | — | WO | disclosed |