Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.34 |
| ▸ | TNKS | O95271 | 1/20 | 0.34 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.34 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
| ▸ | GPR3 | P46089 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22454405 | 0.94 | ESR2 (0.43) | ESR2ESR1ALDH1A1MAPTHPGD | |
| SCHEMBL22454653 | 0.94 | ESR2 (0.46) | ESR2ESR1ALDH1A1MAPTHPGD | |
| SCHEMBL23516205 | 0.94 | ESR2 (0.40) | ESR2ESR1ALDH1A1HPGDLIMK1 | |
| SCHEMBL23516209 | 0.93 | ESR2 (0.39) | ESR2ESR1LIMK1 | |
| SCHEMBL22454547 | 0.92 | ESR2 (0.39) | ESR2ESR1ALDH1A1MAPTHPGD | |
| SCHEMBL22454386 | 0.89 | ESR2 (0.43) | ESR2ESR1ALDH1A1MAPTHPGD | |
| SCHEMBL22454414 | 0.89 | ESR2 (0.41) | ESR2ESR1ALDH1A1MAPTHPGD | |
| SCHEMBL22454416 | 0.89 | ESR2 (0.42) | ESR2ESR1ALDH1A1MAPTHPGD | |
| SCHEMBL24790831 | 0.88 | ESR2 (0.38) | ESR2ESR1MAPTLIMK1 | |
| SCHEMBL23516200 | 0.88 | ESR2 (0.39) | ESR2ESR1LIMK1PRKDC |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022262310-A1 | METHOD FOR SYNTHESIZING BTBF AROMATIC AMINE DERIVATIVES | 广东阿格蕾雅光电材料有限公司 | 2022-12-22 | — | — | WO | disclosed |