Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | KDM5A | P29375 | 1/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.41 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | ASPH | Q12797 | 1/20 | 0.39 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.39 |
| ▸ | TAS2R14 | Q9NYV8 | 4/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.38 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30529592 | 0.90 | PTPN1 (0.41) | PTPN1KDM5AKDM4CKDM5BALDH1A1 | |
| SCHEMBL30612383 | 0.88 | IDO1 (0.43) | PTPN1ALDH1A1KDM4ESMN1; SMN2HTT | |
| SCHEMBL16794676 | 0.82 | PDE1B (0.40) | PTPN1KDM5AALDH1A1SMN1; SMN2TAS2R14 | |
| SCHEMBL30678371 | 0.77 | PDE1B (0.42) | PTPN1ALDH1A1KDM4ESMN1; SMN2BLM | |
| SCHEMBL20504588 | 0.76 | TYK2 (0.39) | SMN1; SMN2BLMPMP22 | |
| SCHEMBL29754326 | 0.76 | PTPN1 (0.38) | PTPN1ALDH1A1KDM4ESMN1; SMN2ASPH | |
| SCHEMBL24263403 | 0.76 | TYK2 (0.48) | ALDH1A1KDM4ESMN1; SMN2TAS2R14USP2 | |
| SCHEMBL1202379 | 0.75 | NTRK1 (0.47) | PTPN1ALDH1A1KDM4ESMN1; SMN2BLM | |
| SCHEMBL18161034 | 0.74 | PDE1B (0.41) | PTPN1ALDH1A1SMN1; SMN2HTTPDE1B | |
| SCHEMBL16794686 | 0.74 | TYK2 (0.47) | — |
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-117043164-A | Imidazopyridazine or pyrazolopyrimidine compounds and compositions | 安锐生物医药科技(广州)有限公司 | 2023-11-10 | — | — | CN | disclosed |