Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | PDIA6 | Q15084 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22015598 | 0.87 | CA2 (0.50) | CA2HRH3PDIA6BRD4BRD9 | |
| SCHEMBL20698762 | 0.83 | CA2 (0.43) | CA2HRH3SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL21962242 | 0.75 | CA2 (0.38) | CA2HRH3PDIA6BRD4BRD9 | |
| SCHEMBL20698828 | 0.74 | HRH3 (0.48) | CA2HRH3SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL22010626 | 0.73 | CA2 (0.44) | CA2CA1CA12CA5ACA7 | |
| SCHEMBL20680948 | 0.72 | CA2 (0.49) | CA2HRH3SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL21893020 | 0.72 | NOS1 (0.44) | CA2HTR7CA1CA12CA4 | |
| SCHEMBL12074778 | 0.70 | HRH3 (0.52) | CA2HRH3BRD4BRD9HTR7 | |
| SCHEMBL5913718 | 0.70 | CA2 (0.43) | CA2HRH3HTR7SLC6A4SLC6A2 | |
| SCHEMBL30567326 | 0.70 | HTR7 (0.48) | CA2HTR7CA1CA12CA4 |
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-2020102574-A1 | THE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-05-22 | — | — | WO | disclosed |