Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR2 | P21452 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.32 |
| ▸ | FDPS | P14324 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL31314242 | 0.88 | DHFR (0.36) | TACR2ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL25856705 | 0.88 | DHFR (0.36) | TACR2ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL25862541 | 0.86 | ALDH1A1 (0.34) | TACR2ALDH1A1KDM4EALDH1A3FDPS | |
| SCHEMBL28934281 | 0.82 | NLRP3 (0.39) | ALDH1A1MAPTHPGDTDP1KDM4E | |
| SCHEMBL30108842 | 0.82 | NLRP3 (0.39) | ALDH1A1MAPTHPGDTDP1KDM4E | |
| SCHEMBL30108812 | 0.81 | ALOX5AP (0.36) | MAPTL3MBTL1LMNA | |
| SCHEMBL28934255 | 0.81 | ALOX5AP (0.36) | MAPTL3MBTL1LMNA | |
| SCHEMBL25260757 | 0.81 | ALDH1A1 (0.37) | TACR2ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL25258312 | 0.80 | ALDH1A1 (0.35) | TACR2ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL29030544 | 0.80 | ALDH1A1 (0.33) | TACR2ALDH1A1MAPTMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023131277-A1 | NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF | 药捷安康(南京)科技股份有限公司 | 2023-07-13 | — | — | WO | disclosed |