Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 9/20 | 1.00 |
| ▸ | CYP2D6 | P10635 | 7/20 | 1.00 |
| ▸ | CYP1A2 | P05177 | 6/20 | 1.00 |
| ▸ | CYP2C19 | P33261 | 6/20 | 1.00 |
| ▸ | LMNA | P02545 | 4/20 | 1.00 |
| ▸ | KMT2A | Q03164 | 4/20 | 1.00 |
| ▸ | CYP2C9 | P11712 | 3/20 | 1.00 |
| ▸ | MEN1 | O00255 | 3/20 | 1.00 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 1.00 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 1.00 |
| ▸ | MAPT | P10636 | 2/20 | 1.00 |
| ▸ | MAPK1 | P28482 | 1/20 | 1.00 |
| ▸ | PMP22 | Q01453 | 1/20 | 1.00 |
| ▸ | IDO1 | P14902 | 1/20 | 0.56 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1322071 | 1.00 | CYP3A4 (1.00) | CYP3A4CYP2D6CYP1A2CYP2C19LMNA | |
| SCHEMBL7235093 | 0.85 | CYP3A4 (0.73) | CYP3A4CYP2D6CYP1A2CYP2C19LMNA | |
| SCHEMBL28084040 | 0.83 | CYP3A4 (0.71) | CYP3A4CYP2D6CYP1A2CYP2C19LMNA | |
| SCHEMBL820508 | 0.82 | CYP3A4 (0.70) | CYP3A4CYP2D6CYP1A2CYP2C19LMNA | |
| SCHEMBL31408101 | 0.80 | IDO1 (0.73) | CYP3A4CYP2D6CYP1A2CYP2C19LMNA | |
| SCHEMBL16382293 | 0.80 | IDO1 (0.73) | CYP3A4CYP2D6CYP1A2CYP2C19LMNA | |
| SCHEMBL27768062 | 0.79 | CYP3A4 (0.66) | CYP3A4CYP2D6CYP1A2CYP2C19LMNA | |
| SCHEMBL28484926 | 0.77 | IDO1 (0.63) | CYP3A4CYP2D6CYP1A2CYP2C19LMNA | |
| SCHEMBL12017706 | 0.77 | CYP1A2 (0.62) | CYP3A4CYP2D6CYP1A2CYP2C19LMNA | |
| SCHEMBL994454 | 0.77 | CYP1A2 (0.62) | CYP3A4CYP2D6CYP1A2CYP2C19LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114437407-A | Vulcanized composition, EPDM-based vulcanized rubber composition, vulcanized rubber, and preparation method and application thereof | 中国石油化工股份有限公司 | 2022-05-06 | — | — | CN | claimed |
| WO-2024224296-A2 | TARGETED PHARMACEUTICAL COMPOSITIONS TO TREAT NEUROLOGICAL CONDITIONS | YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) | 2024-10-31 | — | — | WO | disclosed |
| CN-114437407-A | Vulcanized composition, EPDM-based vulcanized rubber composition, vulcanized rubber, and preparation method and application thereof | 中国石油化工股份有限公司 | 2022-05-06 | — | — | CN | disclosed |