Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8418590 | 0.90 | ALDH1A1 (0.36) | ALDH1A1TSHRADRB2ADRB1LMNA | |
| SCHEMBL4895199 | 0.83 | ALDH1A1 (0.36) | ALDH1A1TSHRADRB2ADRB1LMNA | |
| SCHEMBL28886017 | 0.83 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL8708901 | 0.81 | ALDH1A1 (0.35) | ALDH1A1TSHRADRB2ADRB1LMNA | |
| SCHEMBL10628516 | 0.80 | ALDH1A1 (0.34) | ALDH1A1TSHRADRB2ADRB1LMNA | |
| SCHEMBL28762268 | 0.79 | — | — | |
| SCHEMBL10623860 | 0.77 | ALDH1A1 (0.32) | ALDH1A1TSHRADRB2ADRB1LMNA | |
| SCHEMBL2971587 | 0.76 | TSHR (0.40) | ALDH1A1TSHRLMNASLC6A2SLC6A4 | |
| SCHEMBL7871021 | 0.73 | KDM4E (0.38) | ALDH1A1TSHRADRB2ADRB1LMNA | |
| SCHEMBL10624022 | 0.73 | ALDH1A1 (0.34) | ALDH1A1 |
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-114057961-B | Polymer double-chain/inorganic nanoparticle composite Janus material and preparation method thereof | 清华大学 | 2022-11-18 | — | — | CN | claimed |