Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TNF | P01375 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8185434 | 0.87 | SLC9A1 (0.52) | SMN1; SMN2ALDH1A1NPC1TNFRAB9A | |
| SCHEMBL7995072 | 0.83 | ALDH1A1 (0.53) | SMN1; SMN2ALDH1A1NPC1TNFRAB9A | |
| SCHEMBL27459907 | 0.83 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1NPC1TNFRAB9A | |
| SCHEMBL27438364 | 0.79 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1KDM4EMEN1GAA | |
| SCHEMBL8831863 | 0.79 | SMN1; SMN2 (0.49) | SMN1; SMN2ALDH1A1NPC1TNFRAB9A | |
| SCHEMBL8183089 | 0.79 | SMN1; SMN2 (0.47) | SMN1; SMN2ALDH1A1NPC1TNFRAB9A | |
| Hydrochloric Acid SCHEMBL8379790 | 0.78 | SMN1; SMN2 (0.48) | SMN1; SMN2ALDH1A1NPC1TNFRAB9A | |
| SCHEMBL8374900 | 0.76 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1NPC1TNFRAB9A | |
| SCHEMBL14021961 | 0.76 | SMN1; SMN2 (0.49) | SMN1; SMN2ALDH1A1KMT2ASUCNR1CYP1A2 | |
| SCHEMBL7995147 | 0.75 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1SUCNR1CYP1A2HTR2A |
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-1126202-A | Heterocyclyloxy benzoylguanidin | MERCK PATENT GMBH (DE) | 1996-07-10 | — | — | CN | disclosed |