Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IL1B | P01584 | 8/20 | 0.49 |
| ▸ | NLRP3 | Q96P20 | 6/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 3/20 | 0.43 |
| ▸ | TDO2 | P48775 | 3/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.41 |
| ▸ | TNF | P01375 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29131967 | 1.00 | IL1B (0.49) | IL1BNLRP3KCNH2IDO1TDO2 | |
| SCHEMBL29275687 | 0.93 | NLRP3 (0.44) | IL1BNLRP3KCNH2IDO1TDO2 | |
| SCHEMBL30213908 | 0.89 | IL1B (0.47) | IL1BNLRP3KCNH2IDO1TDO2 | |
| SCHEMBL30214191 | 0.89 | IL1B (0.47) | IL1BNLRP3KCNH2IDO1TDO2 | |
| SCHEMBL31043367 | 0.85 | NLRP3 (0.42) | IL1BNLRP3KCNH2CHEK1CHEK2 | |
| SCHEMBL31043319 | 0.85 | NLRP3 (0.42) | IL1BNLRP3KCNH2CHEK1CHEK2 | |
| SCHEMBL27354972 | 0.85 | NLRP3 (0.42) | IL1BNLRP3KCNH2CHEK1CHEK2 | |
| Formic Acid SCHEMBL30994672 | 0.85 | IL1B (0.44) | IL1BNLRP3KCNH2IDO1TDO2 | |
| SCHEMBL27357230 | 0.85 | NLRP3 (0.47) | IL1BNLRP3KCNH2CHEK1CHEK2 | |
| SCHEMBL31043347 | 0.83 | NLRP3 (0.41) | IL1BNLRP3KCNH2CHEK1CHEK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116969920-A | Fused pyridazine derivative, preparation method and medical application thereof | 上海辉启生物医药科技有限公司 | 2023-10-31 | — | — | CN | disclosed |