Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 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 | |
|---|---|---|---|---|
| SCHEMBL13242652 | 0.77 | APP (0.54) | NPC1RAB9ALCKSMN1; SMN2BCHE | |
| SCHEMBL6388039 | 0.77 | APP (0.54) | NPC1RAB9ALCKSMN1; SMN2BCHE | |
| SCHEMBL763259 | 0.75 | LMNA (0.60) | PPARGGSK3BBACE1HIF1ANPC1 | |
| SCHEMBL2516876 | 0.75 | APP (0.58) | GSK3BBACE1HIF1ARAB9ALCK | |
| SCHEMBL12459750 | 0.73 | GSTP1 (0.58) | GSK3BBACE1HIF1ARAB9ALCK | |
| Hydrochloric Acid SCHEMBL10608433 | 0.73 | PDGFRB (0.39) | TP53PDGFRBMAPTBCHEMEN1 | |
| SCHEMBL13899704 | 0.73 | NPC1 (0.64) | NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL21244006 | 0.73 | APP (0.61) | PPARGPPARATP53NPC1RAB9A | |
| SCHEMBL10226406 | 0.73 | RXRA (0.54) | NPC1RAB9AMAPTSMN1; SMN2KMT2A | |
| SCHEMBL261149 | 0.72 | MEN1 (0.50) | GSK3BBACE1TP53HIF1ANPC1 |
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-107602478-A | A kind of novel benzimidazoles ion monomer and preparation method thereof | 浙江大学 | 2018-01-19 | — | — | CN | disclosed |