Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.54 |
| ▸ | MMP9 | P14780 | 1/20 | 0.51 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.50 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | TUBB1 | Q9H4B7 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.47 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.47 |
| ▸ | TUBB | P07437 | 2/20 | 0.47 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.47 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.47 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.47 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30625282 | 0.90 | CYP1A1 (0.61) | PTGS1MMP9CYP1A1NFE2L2PTGS2 | |
| SCHEMBL2458079 | 0.90 | CYP1A1 (0.61) | PTGS1MMP9CYP1A1NFE2L2PTGS2 | |
| SCHEMBL1301189 | 0.90 | CYP1A1 (0.61) | PTGS1MMP9CYP1A1NFE2L2PTGS2 | |
| SCHEMBL1301186 | 0.90 | CYP1A1 (0.61) | PTGS1MMP9CYP1A1NFE2L2PTGS2 | |
| SCHEMBL16670596 | 0.84 | NFE2L2 (0.51) | PTGS1MMP9NFE2L2ALDH1A1KDM4E | |
| SCHEMBL6587547 | 0.81 | MMP9 (0.58) | PTGS1MMP9CYP1A1NFE2L2PTGS2 | |
| SCHEMBL6587536 | 0.81 | MMP9 (0.58) | PTGS1MMP9CYP1A1NFE2L2PTGS2 | |
| SCHEMBL4631920 | 0.80 | KDM4E (0.67) | PTGS1TUBB1ALDH1A1KDM4EHPGD | |
| SCHEMBL4631918 | 0.80 | KDM4E (0.67) | PTGS1TUBB1ALDH1A1KDM4EHPGD | |
| Malonic Acid SCHEMBL27751245 | 0.80 | NFE2L2 (0.61) | PTGS1CYP1A1NFE2L2PTGS2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8889392-B2 | Monolignol 4-O-methyltransferases and uses thereof | BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) | 2014-11-18 | — | — | US | disclosed |
| US-20120117694-A1 | Novel Monolignol 4-O-Methyltransferases and Uses Thereof | BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) | 2012-05-10 | — | — | US | disclosed |