Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP14 | P50281 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28676035 | 0.82 | CA2 (0.46) | CA2CYP3A4TSHRTDP1ATM | |
| SCHEMBL28661664 | 0.77 | AKR1B1 (0.38) | TSHRTDP1ALDH1A1 | |
| SCHEMBL28665091 | 0.75 | CA1 (0.31) | CA1 | |
| SCHEMBL28660290 | 0.75 | CYP3A4 (0.40) | CA2CYP3A4TSHRTDP1ATM | |
| SCHEMBL22558250 | 0.74 | CYP3A4 (0.57) | CA2CYP3A4TSHRTDP1ATM | |
| SCHEMBL4435605 | 0.70 | CA2 (0.52) | CA2CYP3A4TSHRTDP1ATM | |
| SCHEMBL22557964 | 0.70 | FFAR3 (0.35) | ALDH1A1 | |
| SCHEMBL94798 | 0.68 | CYP3A4 (0.68) | CA2CYP3A4TSHRTDP1ATM | |
| SCHEMBL8515069 | 0.67 | CA2 (0.62) | CA2CYP3A4TSHRTDP1ATM | |
| SCHEMBL2960157 | 0.67 | CA2 (0.62) | CA2CYP3A4TSHRTDP1ATM |
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-113795963-A | Carbonate solvents for non-aqueous electrolytes for metal and metal ion batteries | 斯塞法国公司 | 2021-12-14 | — | — | CN | disclosed |