Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IL1B | P01584 | 4/20 | 0.52 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.48 |
| ▸ | CHEK2 | O96017 | 9/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.41 |
| ▸ | CCNK | O75909 | 2/20 | 0.41 |
| ▸ | CDK7 | P50613 | 2/20 | 0.41 |
| ▸ | CDK9 | P50750 | 2/20 | 0.41 |
| ▸ | CCNH | P51946 | 2/20 | 0.41 |
| ▸ | MNAT1 | P51948 | 2/20 | 0.41 |
| ▸ | CDK12 | Q9NYV4 | 2/20 | 0.41 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.41 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30624974 | 1.00 | IL1B (0.52) | IL1BNLRP3CHEK2KDM4EHSD17B10 | |
| SCHEMBL29131979 | 1.00 | IL1B (0.52) | IL1BNLRP3CHEK2KDM4EHSD17B10 | |
| SCHEMBL28934455 | 0.86 | CHEK2 (0.54) | IL1BNLRP3CHEK2KDM4EHSD17B10 | |
| SCHEMBL28934459 | 0.86 | CHEK2 (0.54) | IL1BNLRP3CHEK2KDM4EHSD17B10 | |
| SCHEMBL30108921 | 0.86 | CHEK2 (0.54) | IL1BNLRP3CHEK2KDM4EHSD17B10 | |
| SCHEMBL28934289 | 0.84 | NLRP3 (0.68) | IL1BNLRP3CHEK2KDM4EHSD17B10 | |
| SCHEMBL30108784 | 0.84 | NLRP3 (0.68) | IL1BNLRP3CHEK2KDM4EHSD17B10 | |
| SCHEMBL28934293 | 0.84 | NLRP3 (0.68) | IL1BNLRP3CHEK2KDM4EHSD17B10 | |
| SCHEMBL24840758 | 0.81 | NLRP3 (0.73) | IL1BNLRP3ALDH1A1 | |
| SCHEMBL30168047 | 0.81 | NLRP3 (0.73) | IL1BNLRP3ALDH1A1 |
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 |