Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRMT5 | O14744 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29993893 | 0.83 | SLC9A1 (0.32) | PRMT5SLC9A1KEAP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL13106159 | 0.82 | PARP1 (0.41) | PRMT5PARP1MAOBPSMB8SLC9A1 | |
| SCHEMBL19489400 | 0.74 | PTPN11 (0.33) | — | |
| SCHEMBL8538654 | 0.74 | PRMT5 (0.37) | PRMT5PARP1MAOBALDH1A1LMNA | |
| Lithium Ion SCHEMBL8540488 | 0.73 | PARP1 (0.35) | PRMT5PARP1MAOBPSMB8POLB | |
| SCHEMBL13067164 | 0.71 | ESR2 (0.49) | MAOBSLC9A1KEAP1TSHRSMN1; SMN2 | |
| SCHEMBL23508727 | 0.71 | PTPN11 (0.34) | CYP1A2CYP2C19ALDH1A1POLB | |
| SCHEMBL22199110 | 0.71 | RECQL (0.36) | SMN1; SMN2NPSR1RECQL | |
| SCHEMBL21653695 | 0.69 | PTPN11 (0.35) | ALDH1A1TSHRSMN1; SMN2HTT | |
| SCHEMBL21631683 | 0.69 | PTPN11 (0.33) | — |
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-116323622-A | Bicyclic heteroaryl derivatives, preparation method and application thereof | 浙江海正药业股份有限公司 | 2023-06-23 | — | — | CN | disclosed |