Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 9/20 | 0.43 |
| ▸ | PDE4A | P27815 | 9/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 7/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 7/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA4 | P22748 | 2/20 | 0.38 |
| ▸ | CA6 | P23280 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TLR4 | O00206 | 1/20 | 0.37 |
| ▸ | VEGFA | P15692 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11844345 | 0.88 | PDE4A (0.51) | PDE4BPDE4APDE4CPDE4DALDH1A1 | |
| SCHEMBL4129415 | 0.87 | PDE4A (0.50) | PDE4BPDE4APDE4CPDE4DALDH1A1 | |
| SCHEMBL17185968 | 0.84 | ALDH1A1 (0.44) | PDE4BPDE4APDE4CPDE4DALDH1A1 | |
| SCHEMBL17185831 | 0.84 | MAPK1 (0.45) | PDE4BPDE4APDE4CPDE4DALDH1A1 | |
| SCHEMBL7419187 | 0.82 | PDE4B (0.66) | PDE4BPDE4APDE4CPDE4DALDH1A1 | |
| SCHEMBL18418762 | 0.81 | ALDH1A1 (0.52) | PDE4BPDE4APDE4CPDE4DALDH1A1 | |
| SCHEMBL28414869 | 0.80 | PTAFR (0.51) | ALDH1A1LMNAUSP2POLBCA1 | |
| SCHEMBL1138835 | 0.79 | SLC6A2 (0.41) | MAOACA1CA2CA4TLR4 | |
| SCHEMBL19270702 | 0.79 | HTR2C (0.39) | PDE4BPDE4APDE4CPDE4DALDH1A1 | |
| SCHEMBL7209583 | 0.77 | ALDH1A1 (0.54) | PDE4AALDH1A1LMNAUSP2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111233599-B | Aromatic ring ortho-iodoalkanone and synthetic method and application thereof | 兰州大学 | 2021-07-20 | — | — | CN | disclosed |
| CN-111233599-A | Aromatic ring ortho-iodoalkanone and synthetic method and application thereof | 兰州大学 | 2020-06-05 | — | — | CN | disclosed |