Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 16/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 13/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27518966 | 0.77 | SLC6A4 (0.41) | SLC6A4SLC6A2KCNH2SLC6A3CYP2D6 | |
| SCHEMBL6618819 | 0.76 | SLC6A4 (0.63) | SLC6A4SLC6A2KCNH2SLC6A3CYP2D6 | |
| SCHEMBL1855360 | 0.73 | CHRM2 (0.46) | SLC6A4SLC6A2KCNH2SLC6A3CYP2D6 | |
| SCHEMBL759018 | 0.72 | SIGMAR1 (0.55) | SLC6A4MEN1KMT2ACHRM2CHRM1 | |
| SCHEMBL10926657 | 0.71 | SIGMAR1 (0.56) | SLC6A4SLC6A2KCNH2SLC6A3CHRM2 | |
| SCHEMBL136235 | 0.70 | GABRA1 (0.35) | SLC6A4SLC6A2SLC6A3CYP2D6MEN1 | |
| SCHEMBL13858163 | 0.70 | SLC6A4 (0.44) | SLC6A4SLC6A2KCNH2SLC6A3CYP2D6 | |
| SCHEMBL2173657 | 0.70 | SLC6A4 (0.46) | SLC6A4SLC6A2KCNH2SLC6A3CYP2D6 | |
| SCHEMBL2698337 | 0.68 | SLC6A2 (0.30) | SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL1051818 | 0.68 | PTGS1 (0.31) | SLC6A4SLC6A2SLC6A3 |
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-107573336-A | Benzheterocycle carboxamide pyridine ketone derivatives and its production and use | 四川大学 | 2018-01-12 | — | — | CN | disclosed |