Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17064760 | 1.00 | ADRA2A (0.46) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL477685 | 0.83 | LMNA (0.53) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL477543 | 0.83 | LMNA (0.53) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL477696 | 0.83 | LMNA (0.53) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL30986717 | 0.83 | LMNA (0.53) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL17064367 | 0.83 | POLB (0.40) | ALDH1A1CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL31067673 | 0.83 | POLB (0.40) | ALDH1A1CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL17237857 | 0.81 | UGT2B7 (0.52) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL28547854 | 0.80 | ALDH1A1 (0.50) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL598905 | 0.79 | ALDH1A1 (0.60) | ADRA2AADRA2BADRA2CADRA1DADRA1A |
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-113307772-B | Human plasma kallikrein inhibitors | 拜奥克里斯特制药公司 | 2024-06-28 | — | — | CN | disclosed |