Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 8/20 | 0.50 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.50 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | GFPT1 | Q06210 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Tegomil Fumarate SCHEMBL17187305 | 0.92 | HCAR2 (0.59) | HCAR2KEAP1NFE2L2ALDH1A1TSHR | |
| SCHEMBL17187303 | 0.92 | HCAR2 (0.59) | HCAR2KEAP1NFE2L2ALDH1A1TSHR | |
| SCHEMBL18416709 | 0.92 | HCAR2 (0.59) | HCAR2KEAP1NFE2L2ALDH1A1TSHR | |
| SCHEMBL17187302 | 0.92 | HCAR2 (0.59) | HCAR2KEAP1NFE2L2ALDH1A1TSHR | |
| SCHEMBL17187306 | 0.85 | HCAR2 (0.68) | HCAR2KEAP1NFE2L2ALDH1A1TSHR | |
| SCHEMBL21780067 | 0.85 | ALDH1A1 (0.45) | HCAR2ALDH1A1TSHRTP53HIF1A | |
| SCHEMBL561279 | 0.85 | HCAR2 (0.50) | HCAR2KEAP1NFE2L2ALDH1A1TSHR | |
| SCHEMBL560988 | 0.85 | HCAR2 (0.50) | HCAR2KEAP1NFE2L2ALDH1A1TSHR | |
| SCHEMBL17187304 | 0.85 | HCAR2 (0.50) | HCAR2KEAP1NFE2L2ALDH1A1TSHR | |
| SCHEMBL12468593 | 0.85 | HCAR2 (0.50) | HCAR2KEAP1NFE2L2ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3131633-B1 | MMF-DERIVATIVES OF ETHYLENEGLYCOLS | ALBRECHT WOLFGANG (DE) | 2020-03-04 | — | — | EP | disclosed |