Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 3/20 | 0.55 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | HTR2B | P41595 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | TYR | P14679 | 1/20 | 0.47 |
| ▸ | MLKL | Q8NB16 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.43 |
| ▸ | HRH1 | P35367 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8498311 | 0.85 | CHRM1 (0.54) | CHRM1TRPA1LMNAADRA1ASLC6A2 | |
| SCHEMBL30442826 | 0.85 | CHRM1 (0.54) | CHRM1TRPA1LMNAADRA1ASLC6A2 | |
| SCHEMBL4273855 | 0.83 | MLKL (0.47) | LMNASLC6A2MEN1KMT2AHTT | |
| SCHEMBL50970 | 0.83 | TRPA1 (0.57) | CHRM1TRPA1LMNAADRA1ASLC6A2 | |
| SCHEMBL8979244 | 0.83 | TRPA1 (0.57) | CHRM1TRPA1LMNAADRA1ASLC6A2 | |
| SCHEMBL10411971 | 0.81 | TYR (0.71) | CHRM1TRPA1LMNAADRA1ASLC6A2 | |
| SCHEMBL11865275 | 0.81 | TYR (0.65) | MEN1KMT2ATYRMAPTCYP2C9 | |
| SCHEMBL17703180 | 0.81 | TYR (0.65) | MEN1KMT2ATYRMAPTCYP2C9 | |
| SCHEMBL4549105 | 0.80 | MAOB (0.54) | LMNASLC6A2HTTMAPTPTGS1 | |
| SCHEMBL14676983 | 0.80 | LMNA (0.53) | CHRM1TRPA1LMNAADRA1ASLC6A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108129389-A | A kind of N- benzyl pyrazoles class compound and preparation method thereof | 西华师范大学 | 2018-06-08 | — | — | CN | disclosed |
| EP-1268502-A1 | O-ARYL GLUCOSIDE SGLT2 INHIBITORS AND METHOD | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-01-02 | — | — | EP | disclosed |
| WO-2001074834-A1 | O-ARYL GLUCOSIDE SGLT2 INHIBITORS AND METHOD | BRISTOL-MYERS SQUIBB COMPANY (US) | 2001-10-11 | — | — | WO | disclosed |