Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | ESR1 | P03372 | 7/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.48 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19762350 | 0.83 | CYP1A2 (0.55) | CYP1A2CYP2C19TSHRCYP2C9LMNA | |
| SCHEMBL111861 | 0.81 | L3MBTL1 (0.64) | CYP1A2CYP2C19TSHRCYP2C9LMNA | |
| SCHEMBL15671512 | 0.80 | LOXL2 (0.58) | TSHRRAB9AALDH1A1 | |
| Lithium SCHEMBL30876327 | 0.80 | L3MBTL1 (0.62) | CYP1A2CYP2C19TSHRCYP2C9LMNA | |
| SCHEMBL7189257 | 0.80 | L3MBTL1 (0.62) | CYP1A2CYP2C19TSHRCYP2C9LMNA | |
| SCHEMBL6057202 | 0.78 | LMNA (0.66) | CYP1A2CYP2C19TSHRCYP2C9LMNA | |
| SCHEMBL5175629 | 0.77 | CYP1A2 (0.67) | CYP1A2CYP2C19TSHRCYP2C9LMNA | |
| SCHEMBL5168199 | 0.77 | CYP1A2 (0.70) | CYP1A2CYP2C19TSHRCYP2C9LMNA | |
| SCHEMBL3870306 | 0.77 | TSHR (0.64) | CYP1A2CYP2C19TSHRCYP2C9LMNA | |
| SCHEMBL11342688 | 0.76 | L3MBTL1 (0.55) | CYP1A2CYP2C19TSHRCYP2C9LMNA |
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-112334454-B | Environment-friendly olefin hydration reaction | 佐治亚州立大学研究基金会公司 | 2024-04-30 | — | — | CN | disclosed |