Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | AR | P10275 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | ESRRG | P62508 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 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 | |
|---|---|---|---|---|
| SCHEMBL11316223 | 0.90 | HPGD (0.42) | HPGDTSHRARESR1CYP3A4 | |
| SCHEMBL7937961 | 0.85 | GAA (0.39) | NFE2L2GAA | |
| SCHEMBL7940638 | 0.82 | TRPV1 (0.44) | SLC6A2SLC6A4SLC6A3MAPTL3MBTL1 | |
| SCHEMBL7937266 | 0.81 | ESR2 (0.61) | HPGDTSHRARESR1CYP3A4 | |
| SCHEMBL7937281 | 0.79 | SOS1 (0.44) | ALDH1A1MEN1KMT2APPARGPPARA | |
| SCHEMBL7937974 | 0.79 | NPC1 (0.36) | MAPTNFE2L2L3MBTL1GAANPC1 | |
| SCHEMBL7937295 | 0.79 | ESR1 (0.41) | ESR1CYP3A4ESR2RORCGAA | |
| SCHEMBL3947712 | 0.78 | ESR1 (0.52) | HPGDTSHRARESR1CYP3A4 | |
| SCHEMBL4348723 | 0.78 | ESR1 (0.52) | HPGDTSHRARESR1CYP3A4 | |
| SCHEMBL7374925 | 0.78 | NFE2L2 (0.55) | HSD17B10MAPTALDH1A1KMT2ANFE2L2 |
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 |