Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.52 |
| ▸ | CA1 | P00915 | 4/20 | 0.52 |
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.37 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.37 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.37 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | GFPT1 | Q06210 | 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 | |
|---|---|---|---|---|
| SCHEMBL20214844 | 0.93 | ZDHHC7 (0.46) | CA2CA1HCAR2KEAP1NFE2L2 | |
| SCHEMBL8683284 | 0.80 | HCAR2 (0.56) | CA2CA1HCAR2KEAP1NFE2L2 | |
| SCHEMBL27340164 | 0.76 | HCAR2 (0.46) | CA2CA1HCAR2KEAP1NFE2L2 | |
| SCHEMBL20207404 | 0.76 | CA2 (0.48) | CA2CA1HCAR2MAPK1TSHR | |
| Dimethyl Maleate SCHEMBL20508358 | 0.75 | HCAR2 (0.77) | CA2CA1HCAR2KEAP1NFE2L2 | |
| SCHEMBL13182503 | 0.74 | CA1 (0.47) | CA2CA1HCAR2KEAP1NFE2L2 | |
| SCHEMBL27877490 | 0.74 | TSHR (0.47) | CA2CA1HCAR2KEAP1NFE2L2 | |
| SCHEMBL4447838 | 0.73 | CA2 (0.50) | CA2CA1HCAR2ATMMAPK1 | |
| SCHEMBL18300757 | 0.73 | ZDHHC7 (0.43) | CA2CA1HCAR2KEAP1NFE2L2 | |
| SCHEMBL18300758 | 0.73 | ZDHHC7 (0.43) | CA2CA1HCAR2KEAP1NFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018096405-A1 | COMPOSITIONS AND METHODS FOR THE TREATMENT OF ORAL INFECTIOUS DISEASES | CELLIX BIO PRIVATE LIMITED (IN) | 2018-05-31 | — | — | WO | disclosed |