Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CETP | P11597 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7300913 | 1.00 | SMN1; SMN2 (0.39) | SMN1; SMN2HIF1ANPC1LMNARAB9A | |
| SCHEMBL7300743 | 0.90 | SMN1; SMN2 (0.44) | SMN1; SMN2HIF1ANPC1LMNARAB9A | |
| SCHEMBL7300739 | 0.90 | SMN1; SMN2 (0.44) | SMN1; SMN2HIF1ANPC1LMNARAB9A | |
| SCHEMBL7299386 | 0.83 | ESR1 (0.47) | SMN1; SMN2HIF1AKIF11CYP3A4 | |
| SCHEMBL7299394 | 0.83 | ESR1 (0.47) | SMN1; SMN2HIF1AKIF11CYP3A4 | |
| SCHEMBL7609842 | 0.75 | PTPN1 (0.43) | SMN1; SMN2NPC1LMNARAB9APTPN1 | |
| Carbamic Acid SCHEMBL10582356 | 0.75 | CNR1 (0.45) | SMN1; SMN2NPC1LMNARAB9AKIF11 | |
| SCHEMBL20541470 | 0.74 | HTT (0.54) | HIF1ALMNAKIF11CYP2D6KCNH2 | |
| SCHEMBL29450628 | 0.73 | SMN1; SMN2 (0.44) | SMN1; SMN2HIF1AKIF11SLC6A2CETP | |
| SCHEMBL29985359 | 0.72 | GAA (0.46) | SMN1; SMN2HIF1AKIF11SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0337714-A2 | HIV protease inhibitors useful for the treatment of aids | MERCK & CO. INC. (US) | 1989-10-18 | — | — | EP | claimed |
| EP-0337714-A2 | HIV protease inhibitors useful for the treatment of aids | MERCK & CO. INC. (US) | 1989-10-18 | — | — | EP | disclosed |