Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CRACR2A | Q9BSW2 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SPR | P35270 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29780914 | 1.00 | NPSR1 (0.40) | NPSR1L3MBTL1CRACR2AOPRK1PDE4B | |
| SCHEMBL29052162 | 0.86 | MAPT (0.41) | CRACR2ATP53MAPTLMNACNR1 | |
| SCHEMBL29780988 | 0.86 | MAPT (0.41) | CRACR2ATP53MAPTLMNACNR1 | |
| SCHEMBL29052610 | 0.84 | PPARA (0.45) | CRACR2ACYP3A4GAACYP2C19SLC6A3 | |
| SCHEMBL29781065 | 0.81 | CNR1 (0.41) | NPSR1L3MBTL1PDE4BMAPTABL1 | |
| SCHEMBL29052606 | 0.81 | CNR1 (0.41) | NPSR1L3MBTL1PDE4BMAPTABL1 | |
| SCHEMBL29052238 | 0.69 | PPARA (0.53) | NPSR1L3MBTL1CRACR2ACYP3A4GAA | |
| SCHEMBL29267467 | 0.69 | SLC6A3 (0.41) | OPRK1PDE4BTP53MAPTLMNA | |
| SCHEMBL29052540 | 0.68 | MAPT (0.43) | TP53MAPTLMNACNR1CNR2 | |
| SCHEMBL29781023 | 0.68 | MAPT (0.43) | TP53MAPTLMNACNR1CNR2 |
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-116583287-A | Pyridazinone heterocyclic compound, preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2023-08-11 | — | — | CN | disclosed |