Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | OGG1 | O15527 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6714893 | 0.80 | ALDH1A1 (0.45) | CES2CES1GSK3BLMNAHDAC1 | |
| SCHEMBL28603750 | 0.80 | CES2 (0.44) | CES2CES1CA1CA2CYP1A2 | |
| SCHEMBL28619042 | 0.80 | CES2 (0.44) | CES2CES1CA1CA2GSK3B | |
| SCHEMBL28472161 | 0.80 | CES2 (0.44) | CES2CES1CA1CA2GSK3B | |
| SCHEMBL28615101 | 0.80 | ALDH1A1 (0.45) | CES2CES1GSK3BLMNAHDAC1 | |
| SCHEMBL6387039 | 0.79 | CES2 (0.48) | CES2CES1CA1CA2GSK3B | |
| SCHEMBL203840 | 0.79 | TDP1 (0.44) | CES2CES1CA1CA2GSK3B | |
| SCHEMBL203839 | 0.79 | TDP1 (0.44) | CES2CES1CA1CA2GSK3B | |
| SCHEMBL28391263 | 0.77 | CYP1A2 (0.53) | CES2CES1CA1CA2GSK3B | |
| SCHEMBL6711126 | 0.77 | PTPN1 (0.46) | GSK3BCYP1A2LMNARAB9AMAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115677627-B | 2,2' -bisfuran compound, and preparation method and application thereof | 华南理工大学 | 2024-04-12 | — | — | CN | disclosed |
| CN-115677627-A | 2,2' -difuran compound and preparation method and application thereof | 华南理工大学 | 2023-02-03 | — | — | CN | disclosed |
| CN-113214283-B | Preparation method of furan macrocyclic compound, prepared furan macrocyclic compound and application | 华南理工大学 | 2022-09-30 | — | — | CN | disclosed |
| CN-113214283-A | Preparation method of furan macrocyclic compound, prepared furan macrocyclic compound and application | 华南理工大学 | 2021-08-06 | — | — | CN | disclosed |