Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.49 |
| ▸ | NAAA | Q02083 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL26588631 | 0.76 | CYP19A1 (0.48) | CYP19A1NAAAALDH1A1LMNAKDM4E | |
| SCHEMBL8403422 | 0.75 | TDP1 (0.56) | CYP19A1NAAAALDH1A1LMNAKDM4E | |
| SCHEMBL432813 | 0.75 | ALDH1A1 (0.56) | CYP19A1ALDH1A1LMNAKDM4EHPGD | |
| SCHEMBL10007758 | 0.74 | TDP1 (0.54) | CYP19A1NAAAALDH1A1LMNAKDM4E | |
| SCHEMBL207015 | 0.74 | NAAA (0.64) | CYP19A1NAAAALDH1A1LMNAKDM4E | |
| SCHEMBL31069913 | 0.72 | NAAA (0.66) | CYP19A1NAAAALDH1A1LMNAKDM4E | |
| SCHEMBL258780 | 0.72 | NAAA (0.66) | CYP19A1NAAAALDH1A1LMNAKDM4E | |
| SCHEMBL7568980 | 0.72 | NAAA (0.66) | CYP19A1NAAAALDH1A1LMNAKDM4E | |
| SCHEMBL28223020 | 0.72 | TDP1 (0.56) | CYP19A1ALDH1A1CYP2C19NPC1 | |
| SCHEMBL10575554 | 0.72 | CYP19A1 (0.57) | CYP19A1ALDH1A1KDM4EHPGDRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3661921-B1 | SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME | NODTHERA LTD (GB) | 2023-10-18 | — | — | EP | disclosed |
| CN-116496255-A | NLRP3 inhibitors | 杭州邦顺制药有限公司 | 2023-07-28 | — | — | CN | disclosed |
| WO-2019025467-A1 | SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME | NodThera Limited (GB) | 2019-02-07 | — | — | WO | disclosed |