Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 8/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | G6PD | P11413 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.33 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30602406 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2LMNATRPV4PTGS2NFE2L2 | |
| SCHEMBL29130946 | 0.82 | ALDH1A1 (0.36) | LMNATRPV4RAB9AALDH1A1KDM4E | |
| SCHEMBL30602411 | 0.82 | ALDH1A1 (0.36) | LMNATRPV4RAB9AALDH1A1KDM4E | |
| SCHEMBL16235616 | 0.72 | CCR4 (0.51) | LMNAALDH1A1MAPTHTT | |
| SCHEMBL29549876 | 0.71 | ALDH1A1 (0.45) | SMN1; SMN2LMNARAB9AALDH1A1KDM4E | |
| SCHEMBL29549875 | 0.71 | ALDH1A1 (0.45) | SMN1; SMN2LMNARAB9AALDH1A1KDM4E | |
| SCHEMBL2047755 | 0.71 | ALDH1A1 (0.45) | SMN1; SMN2LMNARAB9AALDH1A1KDM4E | |
| SCHEMBL12093320 | 0.70 | PGK1 (0.36) | SMN1; SMN2LMNARAB9AALDH1A1KDM4E | |
| SCHEMBL16235761 | 0.69 | PTGS2 (0.36) | SMN1; SMN2PTGS2NFE2L2ALDH1A1MAPK1 | |
| SCHEMBL16235438 | 0.69 | S100A9 (0.52) | ALDH1A1KDM4EMAPK1 |
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-117069724-A | Fused ring compounds, pharmaceutical compositions and uses | 上海赛默罗德生物科技有限公司 | 2023-11-17 | — | — | CN | disclosed |