Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.67 |
| ▸ | PTGS2 | P35354 | 12/20 | 0.62 |
| ▸ | PTGS1 | P23219 | 7/20 | 0.62 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.62 |
| ▸ | HTR1A | P08908 | 1/20 | 0.62 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.62 |
| ▸ | MC4R | P32245 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL2126405 | 1.00 | KMT2A (0.67) | KMT2APTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL29612591 | 1.00 | KMT2A (0.67) | KMT2APTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL2127606 | 1.00 | KMT2A (0.67) | KMT2APTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL2132370 | 1.00 | KMT2A (0.67) | KMT2APTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL22158009 | 0.91 | KMT2A (0.55) | KMT2APTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL17378083 | 0.88 | PTGS2 (0.64) | KMT2APTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL7053045 | 0.82 | PTGS2 (0.44) | KMT2APTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL5071823 | 0.82 | KMT2A (1.00) | KMT2APTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL13743029 | 0.79 | KMT2A (0.79) | KMT2APTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL26996609 | 0.78 | KMT2A (0.76) | KMT2APTGS2PTGS1ABCB11ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114159421-B | Pharmaceutical composition comprising dimethyl fumarate | 阿尔米雷尔有限公司 | 2023-08-25 | — | — | CN | disclosed |
| CN-114159421-A | Pharmaceutical composition comprising dimethyl fumarate | 阿尔米雷尔有限公司 | 2022-03-11 | — | — | CN | disclosed |