Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
| ▸ | RAF1 | P04049 | 2/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.37 |
| ▸ | SELE | P16581 | 2/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 4/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1148857 | 0.88 | ICAM1 (0.38) | LMNARAF1ICAM1SELE | |
| SCHEMBL1148924 | 0.83 | FFAR1 (0.37) | KDM4E | |
| SCHEMBL1149034 | 0.79 | RAF1 (0.35) | RAF1 | |
| SCHEMBL28451829 | 0.79 | BACE1 (0.38) | BACE1DHODHRAF1KIF11SCN9A | |
| SCHEMBL1148855 | 0.78 | ADORA3 (0.38) | BACE1DHODHSCN9A | |
| SCHEMBL1148755 | 0.78 | ICAM1 (0.37) | ICAM1SELE | |
| SCHEMBL1148783 | 0.74 | CCNC (0.38) | RAF1 | |
| SCHEMBL1149261 | 0.73 | RAF1 (0.39) | BACE1KDM4ERAF1 | |
| SCHEMBL1149058 | 0.70 | ICAM1 (0.37) | RAF1ICAM1SELE | |
| SCHEMBL12858180 | 0.69 | DHODH (0.45) | BACE1KDM4ELMNADHODH |
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-110452167-B | Quinoline derivatives, preparation method and application thereof | 东莞市东阳光农药研发有限公司 | 2020-08-21 | — | — | CN | disclosed |