Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | ACE | P12821 | 2/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.39 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.39 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.39 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.39 |
| ▸ | KCND3 | Q9UK17 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31070630 | 0.88 | SLC6A4 (0.50) | SLC6A4SLC6A2SLC6A3CHRNB2CHRNA4 | |
| SCHEMBL30593239 | 0.86 | DRD2 (0.41) | CHRNB2CHRNA4DRD2 | |
| SCHEMBL25604564 | 0.76 | HHAT (0.57) | CHRM3CACNA1FCHRM2CHRM4CHRM5 | |
| SCHEMBL31070610 | 0.76 | DRD2 (0.38) | SLC6A4SLC6A2SLC6A3CHRNB2CHRNA4 | |
| SCHEMBL30593289 | 0.76 | LMNA (0.43) | SLC6A4CHRM3CACNA1FCHRM2CHRM4 | |
| SCHEMBL30593300 | 0.76 | DRD2 (0.49) | DRD2 | |
| SCHEMBL29084782 | 0.73 | DRD1 (0.43) | CHRM3HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL30593320 | 0.72 | CHRM3 (0.45) | CHRM3KCNH2HDAC3HDAC1HDAC2 | |
| SCHEMBL31070552 | 0.72 | SLC6A4 (0.47) | SLC6A4SLC6A2SLC6A3CHRNB2CHRNA4 | |
| SCHEMBL30965951 | 0.72 | TRPM8 (0.60) | CHRM3KCNH2HHATTRPM8 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118742543-A | Dihydro isoquinoline compound and medical application thereof | 中国科学院上海药物研究所 | 2024-10-01 | — | — | CN | disclosed |
| CN-116789641-A | Dihydro isoquinoline compound and medical application thereof | 中国科学院上海药物研究所 | 2023-09-22 | — | — | CN | disclosed |