Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA4 | P43681 | 1/20 | 0.47 |
| ▸ | HMGCR | P04035 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL5156582 | 0.79 | CHRNA4 (0.50) | CHRNA4CA9ALDH1A1KDM4ELMNA | |
| SCHEMBL6857897 | 0.79 | CHRNA4 (0.50) | CHRNA4CA9ALDH1A1KDM4ELMNA | |
| SCHEMBL3060766 | 0.78 | CHRNA4 (0.49) | CHRNA4ALDH1A1KDM4ELMNAMAPT | |
| SCHEMBL28064902 | 0.75 | CHRNA4 (0.47) | CHRNA4ALDH1A1KDM4ELMNAMAPT | |
| SCHEMBL6856049 | 0.73 | CHRNA4 (0.46) | CHRNA4HMGCRCA9ALDH1A1MEN1 | |
| SCHEMBL9752929 | 0.68 | HMGCR (0.50) | HMGCRCA9ALDH1A1MEN1KMT2A | |
| SCHEMBL3407396 | 0.68 | MEN1 (0.65) | HMGCRALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL6863655 | 0.67 | CA9 (0.54) | HMGCRCA9MEN1KMT2AKDM4E | |
| SCHEMBL23665732 | 0.66 | ALDH1A1 (0.61) | CA9ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL6854948 | 0.66 | MAPT (0.34) | ALDH1A1MEN1KMT2AKDM4ELMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-6831177-B1 | Preparation of their intermediates, 2-acyl-5-benzylfuran derivatives and 1,2,4-triazole-3- carboxylic acid ester derivatives | SHIONOGI & CO., LTD. (JP) | 2004-12-14 | — | — | US | disclosed |