Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.50 |
| ▸ | GPR3 | P46089 | 1/20 | 0.47 |
| ▸ | SCN5A | Q14524 | 7/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.46 |
| ▸ | TPX2 | Q9ULW0 | 1/20 | 0.46 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.46 |
| ▸ | SCN1A | P35498 | 1/20 | 0.45 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL255560 | 0.93 | GPR3 (0.52) | KIF11GPR3NISCHGAAMAPT | |
| SCHEMBL7937983 | 0.86 | GPR3 (0.47) | GPR3SCN5AGAAMAPTEPHX2 | |
| SCHEMBL16475036 | 0.84 | NOTUM (0.44) | KIF11GPR3SCN5AAURKATPX2 | |
| SCHEMBL4567624 | 0.84 | ALOX5AP (0.49) | KIF11GPR3SCN5AAURKATPX2 | |
| SCHEMBL254957 | 0.82 | MAPT (0.56) | KIF11GPR3NISCHGAAMAPT | |
| SCHEMBL306823 | 0.81 | KIF11 (0.50) | KIF11SCN5AAURKATPX2NISCH | |
| SCHEMBL18293362 | 0.81 | KIF11 (0.50) | KIF11SCN5AAURKATPX2NISCH | |
| SCHEMBL7940692 | 0.80 | CHRNA7 (0.52) | GPR3GAAMAPTEPHX2MEN1 | |
| SCHEMBL7929139 | 0.80 | SLC6A4 (0.50) | GPR3GAAMAPTKMT2A | |
| SCHEMBL7937974 | 0.79 | NPC1 (0.36) | KIF11GAAMAPTCA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-6242654-B1 | REACTING A PHENOLATE COMPOUND WITH AN ORGANIC FLUORINATING AGENT TO PREPARE A FLUORINE SUBSTITUTED AROMATIC COMPOUND | MITSUI CHEMICALS, INC. (JP) | 2001-06-05 | — | — | US | disclosed |
| EP-1013629-A1 | Preparation process of fluorine subsituted aromatic compound | Mitsui Chemicals, Inc. (JP) | 2000-06-28 | — | — | EP | disclosed |