Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A13 | Q16696 | 5/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3362275 | 0.88 | CYP2A13 (0.59) | CYP2A13KMT2AALDH1A1CYP2C9MEN1 | |
| SCHEMBL28532123 | 0.82 | CYP2A13 (0.55) | CYP2A13KMT2AALDH1A1CYP2C9MEN1 | |
| SCHEMBL11193326 | 0.77 | CYP2A13 (0.75) | CYP2A13KMT2AALDH1A1CYP2C9MEN1 | |
| SCHEMBL5251939 | 0.73 | KMT2A (0.49) | CYP2A13KMT2AALDH1A1MEN1MAPT | |
| SCHEMBL10642464 | 0.73 | ALDH1A1 (0.50) | KMT2AALDH1A1CYP2C9MEN1CYP3A4 | |
| SCHEMBL111727 | 0.73 | CYP2A13 (0.64) | CYP2A13KMT2AALDH1A1CYP2C9MEN1 | |
| SCHEMBL4327006 | 0.73 | MPO (0.75) | CYP2A13KMT2AALDH1A1CYP2C9MEN1 | |
| SCHEMBL22711364 | 0.73 | CYP2A13 (0.64) | CYP2A13KMT2AALDH1A1CYP2C9MEN1 | |
| SCHEMBL4108619 | 0.73 | CYP2A13 (0.69) | CYP2A13KMT2AALDH1A1CYP2C9MEN1 | |
| SCHEMBL2338990 | 0.73 | CYP2A13 (0.64) | CYP2A13KMT2AALDH1A1CYP2C9MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3880659-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | Novartis AG (CH) | 2021-09-22 | — | — | EP | disclosed |
| WO-2020102576-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-05-22 | — | — | WO | disclosed |