Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.46 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.46 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | ELANE | P08246 | 2/20 | 0.43 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL30022211 | 0.94 | GPBAR1 (0.48) | GPBAR1HDAC1HDAC2CYSLTR2CYSLTR1 | |
| SCHEMBL3269912 | 0.94 | GPBAR1 (0.48) | GPBAR1HDAC1HDAC2CYSLTR2CYSLTR1 | |
| SCHEMBL13614140 | 0.87 | MAOA (0.46) | GPBAR1HDAC1HDAC2CYSLTR2CYSLTR1 | |
| SCHEMBL10614795 | 0.85 | HDAC1 (0.48) | HDAC1HDAC2CYSLTR2CYSLTR1CHRM2 | |
| SCHEMBL11935004 | 0.85 | MC4R (0.48) | HDAC1HDAC2CYSLTR2CYSLTR1CHRM2 | |
| SCHEMBL30388584 | 0.84 | KDM1A (0.50) | HDAC1HDAC2CYSLTR2CYSLTR1TP53 | |
| SCHEMBL10616742 | 0.82 | KDM1A (0.49) | HDAC1HDAC2CYSLTR2CYSLTR1CHRM2 | |
| SCHEMBL1038626 | 0.81 | HDAC1 (0.48) | GPBAR1HDAC1HDAC2CYSLTR2CYSLTR1 | |
| SCHEMBL4725706 | 0.81 | MC4R (0.51) | HDAC1HDAC2CYSLTR2CYSLTR1TP53 | |
| SCHEMBL517979 | 0.80 | KCNH2 (0.58) | CHRM2HRH4HRH3LMNACYP1A2 |
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-113307820-B | Quinoline ring-substituted aminophenoxy zinc complex and preparation method and application thereof | 华东理工大学 | 2022-10-25 | — | — | CN | disclosed |
| CN-113307820-A | Quinoline ring-substituted aminophenoxy zinc complex and preparation method and application thereof | 华东理工大学 | 2021-08-27 | — | — | CN | disclosed |