Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25878850 | 0.85 | NFE2L2 (0.50) | NFE2L2TRPA1MAOBALDH1A1MEN1 | |
| SCHEMBL7188391 | 0.77 | NFE2L2 (0.47) | NFE2L2TRPA1ALDH1A1MEN1KMT2A | |
| SCHEMBL7187435 | 0.74 | TRPA1 (0.52) | NFE2L2TRPA1ALDH1A1MEN1KMT2A | |
| SCHEMBL17835456 | 0.74 | NFE2L2 (0.40) | NFE2L2TRPA1ALDH1A1MEN1KMT2A | |
| SCHEMBL4072769 | 0.73 | IDO1 (0.36) | ALDH1A1 | |
| SCHEMBL6882972 | 0.72 | NFE2L2 (0.54) | NFE2L2TRPA1CYP19A1MAOAMAOB | |
| SCHEMBL6882976 | 0.72 | NFE2L2 (0.54) | NFE2L2TRPA1CYP19A1MAOAMAOB | |
| SCHEMBL7188756 | 0.71 | NFE2L2 (0.53) | NFE2L2TRPA1ALDH1A1MEN1KMT2A | |
| SCHEMBL44502 | 0.71 | NFE2L2 (0.68) | NFE2L2TRPA1CYP19A1MAOAMAOB | |
| SCHEMBL44503 | 0.71 | NFE2L2 (0.68) | NFE2L2TRPA1CYP19A1MAOAMAOB |
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-10391418-B2 | Apparatus for vacuum purification | MERCK PATENT GMBH (DE) | 2019-08-27 | — | — | US | disclosed |
| US-20180207545-A1 | APPARATUS FOR VACUUM PURIFICATION | MERCK PATENT GMBH (DE) | 2018-07-26 | — | — | US | disclosed |
| US-9937438-B2 | Method for vacuum purification | MERCK PATENT GMBH (DE) | 2018-04-10 | — | — | US | disclosed |
| US-20160175736-A1 | METHOD FOR VACUUM PURIFICATION | MERCK PATENT GMBH (DE) | 2016-06-23 | — | — | US | disclosed |