Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | CCR8 | P51685 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | PDE8B | O95263 | 1/20 | 0.32 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30006319 | 0.94 | KCNH2 (0.45) | KCNH2CCR1CCR8SMN1; SMN2KMT2A | |
| SCHEMBL30006203 | 0.84 | ALDH1A1 (0.37) | CCR1CCR8SMN1; SMN2NOS3NOS2 | |
| Hydrochloric Acid SCHEMBL4827329 | 0.79 | BDKRB2 (0.46) | KCNH2CCR1CCR8SMN1; SMN2NOS3 | |
| SCHEMBL23153062 | 0.75 | CCR1 (0.38) | KCNH2CCR1CCR8SMN1; SMN2NOS3 | |
| SCHEMBL681574 | 0.73 | KCNH2 (0.64) | KCNH2CCR1CCR8SMN1; SMN2NOS3 | |
| SCHEMBL10373980 | 0.72 | KCNH2 (0.74) | KCNH2CCR1CCR8SMN1; SMN2NOS3 | |
| SCHEMBL2614966 | 0.71 | KDM4E (0.46) | CCR1CCR8SMN1; SMN2NOS3NOS2 | |
| SCHEMBL16227752 | 0.70 | KCNH2 (0.78) | KCNH2CCR1CCR8SMN1; SMN2 | |
| SCHEMBL22299298 | 0.70 | KCNH2 (0.78) | KCNH2CCR1CCR8SMN1; SMN2 | |
| SCHEMBL16228298 | 0.70 | KCNH2 (0.78) | KCNH2CCR1CCR8SMN1; SMN2 |
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-114907257-B | Method for catalyzing non-activated olefin halogenated pyridine through visible light induction | 中国科学院大连化学物理研究所 | 2023-11-24 | — | — | CN | disclosed |
| CN-114907257-A | Method for catalyzing non-activated olefin halopyridination through visible light induction | 中国科学院大连化学物理研究所 | 2022-08-16 | — | — | CN | disclosed |