Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H3 | Q13133 | 7/20 | 0.50 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.45 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.43 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6754441 | 0.85 | NR1H3 (0.53) | NR1H3PLA2G4BPLA2G2A | |
| SCHEMBL11209971 | 0.82 | PLA2G4B (0.61) | NR1H3PLA2G4BCYP2D6 | |
| SCHEMBL6631625 | 0.82 | NR1H3 (0.48) | NR1H3PLA2G4BPLA2G2ATSHRMAPK1 | |
| SCHEMBL18137261 | 0.82 | GLS (0.50) | NR1H3PLA2G4B | |
| SCHEMBL20379485 | 0.81 | NR1H3 (0.48) | NR1H3PLA2G4BPLA2G2A | |
| SCHEMBL31570778 | 0.81 | NR1H3 (0.47) | NR1H3PLA2G4BPLA2G2ATSHRMAPK1 | |
| SCHEMBL4010528 | 0.80 | TP53 (0.51) | NR1H3LTB4RLTB4R2TSHRMAPK1 | |
| SCHEMBL28139482 | 0.78 | NR1H3 (0.47) | NR1H3LTB4RLTB4R2PLA2G2A | |
| SCHEMBL1326762 | 0.77 | CTBP2 (0.60) | L3MBTL1 | |
| SCHEMBL2848980 | 0.76 | NR4A2 (0.62) | LTB4RLTB4R2TSHR |
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-109563043-B | Substituted pyridines as inhibitors of DNMT1 | 葛兰素史密斯克莱知识产权发展有限公司 | 2022-05-31 | — | — | CN | disclosed |