Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | MPO | P05164 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28967476 | 0.85 | PDE4B (0.41) | MPOALDH1A1LMNAL3MBTL1ATM | |
| SCHEMBL28967478 | 0.85 | ALDH1A1 (0.38) | MPOTSHRALDH1A1LMNAATM | |
| SCHEMBL28967467 | 0.82 | MPO (0.51) | ADORA3ADORA2AMPOALDH1A1L3MBTL1 | |
| SCHEMBL28967455 | 0.81 | MPO (0.41) | ADORA3ADORA2AMPOTSHRALDH1A1 | |
| SCHEMBL28967463 | 0.78 | MPO (0.41) | ADORA3ADORA2AMPOTSHRALDH1A1 | |
| SCHEMBL28967454 | 0.78 | STAT1 (0.43) | MPOLMNAL3MBTL1HTTATM | |
| SCHEMBL28967452 | 0.77 | RAB9A (0.41) | ADORA3ADORA2AMPOTSHRLMNA | |
| SCHEMBL28967458 | 0.77 | ESR2 (0.43) | ADORA3ADORA2AMPOALDH1A1LMNA | |
| SCHEMBL28967453 | 0.77 | PTGS1 (0.43) | MPOALDH1A1ATMKMT2AMAPT | |
| SCHEMBL28967474 | 0.76 | MPO (0.46) | ADORA3ADORA2AMPOALDH1A1HTT |
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-115613060-A | Method for synthesizing C-3 phosphorylated 2H-indazole compound by direct electrochemical oxidation | 浙江工业大学 | 2023-01-17 | — | — | CN | disclosed |