Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HMGCR | P04035 | 1/20 | 0.36 |
| ▸ | FLT3 | P36888 | 1/20 | 0.36 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9697139 | 0.78 | ALDH1A1 (0.41) | ALDH1A1KMT2AKDM4EMEN1GAA | |
| SCHEMBL9696134 | 0.78 | GCGR (0.39) | ALDH1A1KMT2AKDM4EHPGDMEN1 | |
| SCHEMBL9695120 | 0.77 | KDM4E (0.46) | IDO1ALDH1A1KMT2AKDM4EHPGD | |
| SCHEMBL10691696 | 0.74 | ALDH1A1 (0.36) | ALDH1A1KMT2AKDM4EHPGDMEN1 | |
| SCHEMBL9752965 | 0.72 | MAPK14 (0.43) | ALDH1A1KMT2AMEN1PTGS2 | |
| SCHEMBL6241912 | 0.72 | HMGCR (0.57) | PTGS2HMGCR | |
| SCHEMBL6327616 | 0.72 | HMGCR (0.57) | PTGS2HMGCR | |
| SCHEMBL27635670 | 0.72 | HMGCR (0.57) | PTGS2HMGCR | |
| SCHEMBL10679732 | 0.72 | HMGCR (0.57) | PTGS2HMGCR | |
| SCHEMBL27860649 | 0.69 | IDO1 (0.52) | IDO1ALDH1A1KMT2AKDM4EHPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5124453-A | Treatment of corresponding aldehyde with lithium bis(tri-methylsilyl)amide | E. R. SQUIBB & SONS, INC. (US) | 1992-06-23 | — | — | US | disclosed |
| EP-0444532-A1 | Phosphorus-containing HMG-CoA reductase inhibitors, new intermediates and method | E.R. SQUIBB & SONS, INC. (US) | 1991-09-04 | — | — | EP | disclosed |
| US-5025000-A | Anticholesterol, antilipemic agents | E. R. SQUIBB & SONS, INC. (US) | 1991-06-18 | — | — | US | disclosed |
| EP-0265640-A2 | Azaindole and indolizine derivatives, processes for their production and their use as pharmaceuticals | SANDOZ AG (CH) | 1988-05-04 | — | — | EP | disclosed |