Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.30 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.30 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA5A | P35218 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL413377 | 0.83 | ALDH1A1 (0.41) | PTGS2HTR6CA1CA2CA9 | |
| Benzene SCHEMBL8170940 | 0.82 | — | — | |
| Fluorobenzene SCHEMBL27951760 | 0.81 | KMT2A (0.38) | PTGS2 | |
| Naphthalene SCHEMBL8355966 | 0.80 | CYP2A6 (0.38) | CA1CA2CA5ACA9 | |
| Phenol SCHEMBL9645845 | 0.79 | TDP1 (0.46) | CA1CA2CA9 | |
| Toluene SCHEMBL2923984 | 0.79 | LMNA (0.46) | CA1CA2CA9 | |
| SCHEMBL10584897 | 0.79 | SRC (0.31) | HTR6CA1CA2CA5ACA9 | |
| Chlorobenzene SCHEMBL8552009 | 0.79 | TSHR (0.46) | — | |
| Diphenylether SCHEMBL16004650 | 0.78 | LTA4H (0.48) | CA1CA2CA9 | |
| SCHEMBL27738800 | 0.77 | LMNA (0.36) | — |
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-109761875-A | A kind of new method constructing amido bond | 盐城工学院 | 2019-05-17 | — | — | CN | claimed |
| CN-109761875-A | A kind of new method constructing amido bond | 盐城工学院 | 2019-05-17 | — | — | CN | disclosed |