Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 2/20 | 0.49 |
| ▸ | ACHE | P22303 | 3/20 | 0.48 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | GLA | P06280 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8160726 | 0.84 | ESR1 (0.61) | ALOX15ACHEESR1HIF1AKMT2A | |
| SCHEMBL18322432 | 0.80 | ACHE (0.50) | ALOX15ACHEESR1HIF1AKMT2A | |
| SCHEMBL7537504 | 0.80 | L3MBTL1 (0.59) | ALOX15ACHEESR1HIF1AKMT2A | |
| SCHEMBL11332752 | 0.78 | ACHE (0.59) | ALOX15ACHEESR1HIF1AKMT2A | |
| SCHEMBL19774166 | 0.78 | ACHE (0.51) | ALOX15ACHEESR1HIF1AKMT2A | |
| SCHEMBL3834865 | 0.77 | CYP1A2 (0.56) | ALOX15ACHEESR1HIF1AKMT2A | |
| SCHEMBL28756384 | 0.77 | ACHE (0.50) | ALOX15ACHEESR1HIF1AKMT2A | |
| SCHEMBL9799902 | 0.77 | CYP1A2 (0.56) | ALOX15ACHEESR1HIF1AKMT2A | |
| SCHEMBL20593459 | 0.77 | ALOX15 (0.55) | ALOX15ACHEESR1HIF1AKMT2A | |
| SCHEMBL5929563 | 0.77 | ACHE (0.50) | ALOX15ACHEKMT2AGAAKDM4E |
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-111574322-A | Preparation method of difluoromethyl aromatic compound | 南京工业大学 | 2020-08-25 | — | — | CN | disclosed |