Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.51 |
| ▸ | CASP6 | P55212 | 1/20 | 0.49 |
| ▸ | RXRA | P19793 | 1/20 | 0.48 |
| ▸ | RXRB | P28702 | 1/20 | 0.48 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.48 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.47 |
| ▸ | GLS | O94925 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | AGXT | P21549 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | F13A1 | P00488 | 3/20 | 0.44 |
| ▸ | FLT3 | P36888 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11251951 | 1.00 | MAPT (0.51) | MAPTRXFP1CASP6RXRARXRB | |
| SCHEMBL30076529 | 1.00 | MAPT (0.51) | MAPTRXFP1CASP6RXRARXRB | |
| SCHEMBL5640993 | 0.98 | CASP6 (0.50) | MAPTRXFP1CASP6RXRARXRB | |
| SCHEMBL23804835 | 0.94 | CYP1A2 (0.51) | CASP6RXRARXRBNR4A2LOXL2 | |
| SCHEMBL7248298 | 0.87 | LOXL2 (0.53) | MAPTRXRARXRBNR4A2LOXL2 | |
| SCHEMBL20378814 | 0.82 | GLS (0.46) | MAPTLOXL2GLSDRD2HTR2B | |
| SCHEMBL9573690 | 0.81 | MAPT (0.41) | MAPTLOXL2GLSAGXTESR1 | |
| SCHEMBL4432584 | 0.79 | LOXL2 (0.55) | MAPTLOXL2GLSDRD2HTR2B | |
| SCHEMBL10368235 | 0.79 | LOXL2 (0.55) | LOXL2GLSCYP1A2HTR2BAGXT | |
| SCHEMBL21148536 | 0.78 | MMP2 (0.60) | LOXL2GLSHDAC3HDAC4HDAC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115043850-B | Method for synthesizing chiral oxygen-containing octatomic ring compound through palladium-catalyzed asymmetric allyl cycloaddition reaction | 山东大学 | 2024-02-02 | — | — | CN | disclosed |
| CN-115043850-A | Method for synthesizing chiral oxygen-containing eight-membered ring compound through palladium-catalyzed asymmetric allylic cycloaddition reaction | 山东大学 | 2022-09-13 | — | — | CN | disclosed |