Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.39 |
| ▸ | TMPRSS6 | Q8IU80 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | JAK2 | O60674 | 4/20 | 0.38 |
| ▸ | JAK1 | P23458 | 2/20 | 0.38 |
| ▸ | TYK2 | P29597 | 2/20 | 0.38 |
| ▸ | JAK3 | P52333 | 2/20 | 0.38 |
| ▸ | BUB1 | O43683 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29922466 | 1.00 | ABCB1 (0.41) | ABCB1ABCG2F2ALDH1A1MAPT | |
| SCHEMBL28358863 | 1.00 | ABCB1 (0.41) | ABCB1ABCG2F2ALDH1A1MAPT | |
| SCHEMBL29552236 | 0.92 | ABCB1 (0.43) | ABCB1ABCG2F2ALDH1A1MAPT | |
| SCHEMBL28358981 | 0.91 | JAK1 (0.47) | ABCB1ABCG2F2ALDH1A1MAPT | |
| SCHEMBL29551854 | 0.91 | JAK1 (0.47) | ABCB1ABCG2F2ALDH1A1MAPT | |
| SCHEMBL28358944 | 0.85 | JAK2 (0.51) | ABCG2F2MAPTNPC1RAB9A | |
| SCHEMBL29922577 | 0.85 | JAK2 (0.51) | ABCG2F2MAPTNPC1RAB9A | |
| SCHEMBL28359299 | 0.84 | DHODH (0.44) | MAPTJAK2JAK1TYK2JAK3 | |
| SCHEMBL29922511 | 0.84 | DHODH (0.44) | MAPTJAK2JAK1TYK2JAK3 | |
| SCHEMBL29551921 | 0.82 | ABCB1 (0.45) | ABCB1ABCG2F2ALDH1A1MAPT |
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-2022032484-A1 | PYRIDAZINE-3-FORMAMIDE COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 北京诺诚健华医药科技有限公司 | 2022-02-17 | — | — | WO | disclosed |