Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 3/20 | 0.51 |
| ▸ | IL1B | P01584 | 8/20 | 0.47 |
| ▸ | TNF | P01375 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | PDE5A | O76074 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL26437127 | 0.88 | IL1B (0.45) | NLRP3IL1BTNFKDM4EALDH1A1 | |
| SCHEMBL26437772 | 0.87 | IL1B (0.44) | NLRP3IL1BTNFPDK2 | |
| SCHEMBL30624984 | 0.85 | IL1B (0.63) | NLRP3IL1BTNFKDM4EHSD17B10 | |
| SCHEMBL26435305 | 0.85 | IL1B (0.63) | NLRP3IL1BTNFKDM4EHSD17B10 | |
| SCHEMBL26437141 | 0.85 | NLRP3 (0.59) | NLRP3IL1BKDM4EHSD17B10ALDH1A1 | |
| SCHEMBL26441653 | 0.85 | NLRP3 (0.55) | NLRP3IL1BTNFKDM4EHSD17B10 | |
| SCHEMBL26093229 | 0.85 | NLRP3 (0.55) | NLRP3IL1BTNFKDM4EHSD17B10 | |
| SCHEMBL26438470 | 0.85 | NLRP3 (0.55) | NLRP3IL1BTNFKDM4EHSD17B10 | |
| SCHEMBL26437583 | 0.84 | IL1B (0.51) | NLRP3IL1BTNF | |
| SCHEMBL26437137 | 0.84 | NLRP3 (0.51) | NLRP3IL1BTNFKDM4EHSD17B10 |
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-2023066377-A1 | NITROGEN-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 索智生物科技（浙江）有限公司 | 2023-04-27 | — | — | WO | disclosed |