Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13593734 | 0.89 | CHRNA1 (0.41) | SMN1; SMN2LMNA | |
| SCHEMBL3280576 | 0.87 | CHRNA1 (0.41) | MAPK1SMN1; SMN2SIGMAR1CYP1A2ALDH1A1 | |
| SCHEMBL14779113 | 0.85 | TSHR (0.47) | L3MBTL1TSHRMAPK1SMN1; SMN2GRIN1 | |
| SCHEMBL3279952 | 0.83 | ALDH1A1 (0.37) | ALDH1A1TDP1 | |
| SCHEMBL14777960 | 0.78 | GRIN1 (0.44) | L3MBTL1TSHRMAPK1SMN1; SMN2GRIN1 | |
| SCHEMBL14777801 | 0.78 | GRIN1 (0.44) | L3MBTL1TSHRMAPK1SMN1; SMN2GRIN1 | |
| SCHEMBL3280780 | 0.75 | VDR (0.39) | — | |
| SCHEMBL2855025 | 0.74 | KMT2A (0.32) | L3MBTL1LMNAMEN1KMT2AALDH1A1 | |
| SCHEMBL11738097 | 0.73 | ALDH1A1 (0.39) | L3MBTL1TSHRMAPK1SMN1; SMN2CYP1A2 | |
| SCHEMBL14559519 | 0.72 | GRIN1 (0.43) | L3MBTL1TSHRMAPK1SMN1; SMN2GRIN1 |
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-110054541-A | A kind of preparation method of deuterated aromatic compound | 安徽秀朗新材料科技有限公司 | 2019-07-26 | — | — | CN | disclosed |