Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.52 |
| ▸ | MGLL | Q99685 | 1/20 | 0.51 |
| ▸ | HRH2 | P25021 | 5/20 | 0.51 |
| ▸ | HRH1 | P35367 | 5/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29139529 | 0.82 | MGLL (0.56) | GAAMGLLCYP2D6 | |
| SCHEMBL27629467 | 0.81 | SIGMAR1 (0.56) | HRH2HRH1 | |
| SCHEMBL28015716 | 0.80 | CHRM3 (0.58) | GAACHRM3HRH2HRH1KCNH2 | |
| SCHEMBL11882343 | 0.80 | MGLL (0.72) | GAAMGLLCYP2D6 | |
| SCHEMBL10666406 | 0.79 | GAA (0.63) | GAAMGLL | |
| SCHEMBL14040454 | 0.79 | KMT2A (0.55) | GAAMGLLCYP2D6 | |
| SCHEMBL5104855 | 0.79 | GAA (0.66) | GAAMGLL | |
| SCHEMBL16980657 | 0.78 | SIGMAR1 (0.72) | HRH2HRH1KCNH2 | |
| SCHEMBL27647465 | 0.78 | MGLL (0.57) | GAAMGLLCYP2D6 | |
| SCHEMBL10723980 | 0.77 | SIGMAR1 (0.70) | CHRM3HRH2HRH1KCNH2 |
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-109561680-A | small molecule modulators of pantothenate kinase | 圣朱德儿童研究医院 | 2019-04-02 | — | — | CN | disclosed |