Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL417319 | 1.00 | CHRM2 (0.47) | CHRM2CHRM4CHRM3CHRNB2CHRNB4 | |
| SCHEMBL3000349 | 0.92 | CHRM2 (0.43) | CHRM2CHRM4CHRM3TP53SLC6A2 | |
| SCHEMBL31010892 | 0.88 | CHRM2 (0.47) | CHRM2CHRM4CHRM3CHRNB2CHRNB4 | |
| SCHEMBL29726716 | 0.84 | CHRM2 (0.47) | CHRM2CHRM4CHRM3CHRNB2CHRNB4 | |
| SCHEMBL19250570 | 0.84 | CHRM2 (0.47) | CHRM2CHRM4CHRM3CHRNB2CHRNB4 | |
| SCHEMBL27581302 | 0.84 | CHRM2 (0.41) | CHRM2CHRM4CHRM3ALDH1A1KMT2A | |
| SCHEMBL30945484 | 0.81 | CHRM2 (0.43) | CHRM2CHRM4CHRM3CHRNB2CHRNB4 | |
| SCHEMBL15483937 | 0.81 | CHRM2 (0.43) | CHRM2CHRM4CHRM3CHRNB2CHRNB4 | |
| SCHEMBL31017141 | 0.81 | POLB (0.33) | CHRM2CHRM4CHRM3CHRNB2CHRNB4 | |
| SCHEMBL9977681 | 0.81 | CHRM2 (0.45) | CHRM2CHRM4CHRM3CHRNB2CHRNB4 |
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-117460721-A | LPA1 small molecule antagonist | 上海拓界生物医药科技有限公司 | 2024-01-26 | — | — | CN | disclosed |