Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 11/20 | 0.95 |
| ▸ | ESR2 | Q92731 | 11/20 | 0.95 |
| ▸ | KIF11 | P52732 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | TYR | P14679 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | ESRRG | P62508 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL4560440 | 0.97 | ESR1 (1.00) | ESR1ESR2KIF11CYP3A4LMNA | |
| SCHEMBL21027 | 0.97 | ESR1 (1.00) | ESR1ESR2KIF11CYP3A4LMNA | |
| SCHEMBL3686864 | 0.97 | ESR1 (1.00) | ESR1ESR2KIF11CYP3A4LMNA | |
| SCHEMBL30625966 | 0.95 | ESR1 (0.95) | ESR1ESR2KIF11CYP3A4LMNA | |
| SCHEMBL6059489 | 0.90 | ESR1 (0.86) | ESR1ESR2KIF11CYP3A4LMNA | |
| SCHEMBL10906373 | 0.90 | ESR1 (0.86) | ESR1ESR2KIF11CYP3A4LMNA | |
| SCHEMBL7935379 | 0.90 | ESR1 (0.86) | ESR1ESR2KIF11CYP3A4LMNA | |
| SCHEMBL6059770 | 0.90 | ESR1 (0.86) | ESR1ESR2KIF11CYP3A4LMNA | |
| SCHEMBL8488305 | 0.88 | ESR1 (0.82) | ESR1ESR2KIF11CYP3A4LMNA | |
| SCHEMBL28278720 | 0.88 | ESR1 (0.82) | ESR1ESR2KIF11CYP3A4LMNA |
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-113620814-B | Green preparation method of 2, 2-bis (4-aminophenyl) hexafluoropropane | 三明市海斯福化工有限责任公司 | 2023-12-26 | — | — | CN | disclosed |