Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.48 |
| ▸ | KAT2B | Q92831 | 6/20 | 0.37 |
| ▸ | IL1B | P01584 | 3/20 | 0.36 |
| ▸ | ANO1 | Q5XXA6 | 3/20 | 0.35 |
| ▸ | CNR1 | P21554 | 2/20 | 0.35 |
| ▸ | COMT | P21964 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL26435870 | 1.00 | KCNH2 (0.48) | KCNH2NLRP3KAT2BIL1BANO1 | |
| SCHEMBL26093543 | 1.00 | KCNH2 (0.48) | KCNH2NLRP3KAT2BIL1BANO1 | |
| SCHEMBL26435893 | 0.92 | KCNH2 (0.48) | KCNH2NLRP3KAT2BIL1BANO1 | |
| SCHEMBL26435356 | 0.88 | NLRP3 (0.52) | KCNH2NLRP3KAT2BIL1BCOMT | |
| SCHEMBL26437123 | 0.87 | NLRP3 (0.41) | KCNH2NLRP3KAT2BCNR1COMT | |
| SCHEMBL26435303 | 0.86 | NLRP3 (0.52) | KCNH2NLRP3IL1BCNR1KDM4E | |
| SCHEMBL30375062 | 0.85 | NLRP3 (0.68) | KCNH2NLRP3IL1BKDM4E | |
| SCHEMBL26435693 | 0.85 | NLRP3 (0.68) | KCNH2NLRP3IL1BKDM4E | |
| SCHEMBL26438939 | 0.85 | NLRP3 (0.68) | KCNH2NLRP3IL1BKDM4E | |
| SCHEMBL26093704 | 0.85 | NLRP3 (0.68) | KCNH2NLRP3IL1BKDM4E |
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-116102535-A | Nitrogen-containing compound, preparation method and application thereof | 索智生物科技（浙江）有限公司 | 2023-05-12 | — | — | CN | disclosed |