Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22019791 | 0.76 | DRD4 (0.34) | — | |
| SCHEMBL447510 | 0.74 | KDM4E (0.61) | KDM4EMEN1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL21127854 | 0.73 | NOS3 (0.33) | — | |
| Hydrochloric Acid SCHEMBL11161014 | 0.73 | KDM4E (0.59) | KDM4EMEN1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL6275736 | 0.72 | KDM4E (0.33) | KDM4EMEN1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL24854374 | 0.70 | KDM4E (0.32) | KDM4E | |
| SCHEMBL22021016 | 0.68 | — | — | |
| SCHEMBL4466115 | 0.68 | KDM4E (0.58) | KDM4EMEN1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL12673717 | 0.67 | KMT2A (0.39) | KDM4EMEN1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL20092527 | 0.64 | JAK2 (0.32) | — |
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-2020102096-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-05-22 | — | — | WO | disclosed |