Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR1B | P28222 | 1/20 | 0.36 |
| ▸ | HTR1F | P30939 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29141633 | 1.00 | CHRNB2 (0.40) | CHRNB2CHRNB4CHRNA3CHRNA4GAA | |
| SCHEMBL29601431 | 0.87 | CHRNB2 (0.42) | CHRNB2CHRNB4CHRNA3CHRNA4GAA | |
| SCHEMBL30267526 | 0.82 | CHRNB2 (0.41) | CHRNB2CHRNB4CHRNA3CHRNA4HTR6 | |
| SCHEMBL28649101 | 0.82 | CHRNB2 (0.41) | CHRNB2CHRNB4CHRNA3CHRNA4HTR6 | |
| SCHEMBL28558398 | 0.81 | CHRNB2 (0.38) | CHRNB2CHRNB4CHRNA3CHRNA4GAA | |
| SCHEMBL29538386 | 0.81 | CHRNB2 (0.38) | CHRNB2CHRNB4CHRNA3CHRNA4GAA | |
| Fumaric Acid SCHEMBL30911879 | 0.79 | CHRNB2 (0.40) | CHRNB2CHRNB4CHRNA3CHRNA4GAA | |
| SCHEMBL29601544 | 0.77 | CHRNB2 (0.39) | CHRNB2CHRNB4CHRNA3CHRNA4GAA | |
| SCHEMBL28054466 | 0.77 | CHRNB2 (0.39) | CHRNB2CHRNB4CHRNA3CHRNA4GAA | |
| SCHEMBL29141637 | 0.77 | TP53 (0.40) | CHRNB2CHRNB4CHRNA3CHRNA4GAA |
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-115448907-B | Compound for treating peptic ulcer, intermediate and preparation method thereof | 赛隆药业集团股份有限公司 | 2024-01-12 | — | — | CN | disclosed |