Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 6/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.32 |
| ▸ | NPC1 | O15118 | 4/20 | 0.32 |
| ▸ | RAB9A | P51151 | 4/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 4/20 | 0.32 |
| ▸ | HTT | P42858 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL504447 | 0.79 | LMNA (0.36) | CYP2D6CYP2C19MAPTPOLBLMNA | |
| SCHEMBL11088915 | 0.76 | ALDH1A1 (0.43) | CYP2D6CYP2C19ALDH1A1MAPTPOLB | |
| SCHEMBL27328209 | 0.75 | IDO1 (0.36) | CYP2C19ALDH1A1MAPTLMNAKMT2A | |
| SCHEMBL6695142 | 0.72 | CHRM5 (0.36) | — | |
| SCHEMBL9408950 | 0.72 | SMN1; SMN2 (0.38) | CYP2D6CYP2C19ALDH1A1LMNAKMT2A | |
| SCHEMBL8207622 | 0.68 | CYP2D6 (0.42) | CYP2D6CYP2C19ALDH1A1MAPTPOLB | |
| Bromide SCHEMBL9368680 | 0.67 | CYP2D6 (0.47) | CYP2D6CYP2C19ALDH1A1POLBLMNA | |
| SCHEMBL30749067 | 0.65 | CYP2D6 (0.44) | CYP2D6CYP2C19ALDH1A1MAPTPOLB | |
| SCHEMBL14344896 | 0.64 | CYP2D6 (0.47) | CYP2D6CYP2C19ALDH1A1POLBLMNA | |
| SCHEMBL12574808 | 0.64 | CYP2D6 (0.43) | CYP2D6CYP2C19ALDH1A1MAPTPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000061561-A1 | CYANOGUANIDINE COMPOUNDS | SHIONOGI BIORESEARCH CORP. (US) | 2000-10-19 | — | — | WO | disclosed |