Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | GPR3 | P46089 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | RORC | P51449 | 2/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CASR | P41180 | 1/20 | 0.36 |
| ▸ | CCR6 | P51684 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | PTGIR | P43119 | 1/20 | 0.35 |
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 | 0.85 | GPR3 (0.52) | GPR3GAAEPHX2MAPTHSD11B1 | |
| SCHEMBL7937295 | 0.85 | ESR1 (0.41) | ESR1ESR2GPR3GAARORC | |
| SCHEMBL7929127 | 0.82 | ESR1 (0.59) | ESR1ESR2GAARORCMAPT | |
| SCHEMBL7938037 | 0.82 | ESR1 (0.69) | ESR1ESR2GAATRPV1EPHX2 | |
| SCHEMBL7938513 | 0.80 | NFE2L2 (0.52) | ESR1ESR2RORCMAPTHSD11B1 | |
| SCHEMBL7940638 | 0.80 | TRPV1 (0.44) | GPR3GAATRPV1EPHX2MAPT | |
| SCHEMBL7938385 | 0.79 | KIF11 (0.50) | GPR3GAAEPHX2MAPTHSD11B1 | |
| SCHEMBL7937983 | 0.79 | GPR3 (0.47) | GPR3GAAEPHX2MAPTHSD11B1 | |
| SCHEMBL7937282 | 0.76 | ESR1 (0.52) | ESR1ESR2HSD11B1KIF11 | |
| SCHEMBL24495838 | 0.75 | ESR1 (0.46) | ESR1ESR2GAATRPV1EPHX2 |
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 |