Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 2/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | LIN28A | Q9H9Z2 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28985180 | 1.00 | HRH1 (0.50) | HRH1HRH3LMNAALDH1A1TAAR1 | |
| SCHEMBL10810253 | 1.00 | HRH1 (0.50) | HRH1HRH3LMNAALDH1A1TAAR1 | |
| SCHEMBL18751372 | 0.86 | HRH3 (0.42) | HRH1HRH3LMNAALDH1A1TAAR1 | |
| SCHEMBL6428024 | 0.83 | HRH1 (0.50) | HRH1HRH3LMNAALDH1A1TAAR1 | |
| SCHEMBL248607 | 0.83 | HRH1 (0.50) | HRH1HRH3LMNAALDH1A1TAAR1 | |
| SCHEMBL466381 | 0.83 | — | — | |
| SCHEMBL1760709 | 0.80 | HRH1 (0.52) | HRH1HRH3LMNAALDH1A1TAAR1 | |
| SCHEMBL1760708 | 0.80 | HRH1 (0.52) | HRH1HRH3LMNAALDH1A1TAAR1 | |
| SCHEMBL11034424 | 0.79 | HRH1 (0.45) | HRH1HRH3LMNAALDH1A1TAAR1 | |
| SCHEMBL6159415 | 0.79 | HRH1 (0.45) | HRH1HRH3LMNAALDH1A1TAAR1 |
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-115974927-A | Diamine-derived phosphine chiral phosphine oxide ligand-promoted nickel-catalyzed asymmetric alkylation of pyridine C2-H bond | 南开大学 | 2023-04-18 | — | — | CN | disclosed |