Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.42 |
| ▸ | CES1 | P23141 | 3/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | UNG | P13051 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.38 |
| ▸ | CHRNG | P07510 | 1/20 | 0.38 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.38 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1088403 | 0.84 | CES2 (0.54) | CES2CES1TDP1L3MBTL1ATM | |
| SCHEMBL9398543 | 0.71 | ALDH1A1 (0.44) | CES2CES1ACHETDP1L3MBTL1 | |
| SCHEMBL7945435 | 0.70 | GAA (0.59) | ACHETDP1L3MBTL1ATMGSK3B | |
| SCHEMBL27508742 | 0.68 | ALDH1A1 (0.44) | CES2CES1TDP1L3MBTL1CYP2C19 | |
| SCHEMBL30803096 | 0.68 | CES1 (0.56) | CES2CES1TDP1L3MBTL1ATM | |
| SCHEMBL503007 | 0.67 | TDP1 (0.68) | CES2CES1TDP1L3MBTL1ATM | |
| SCHEMBL8875628 | 0.67 | CA12 (0.50) | TDP1L3MBTL1ATMUNGALDH1A1 | |
| SCHEMBL25031716 | 0.65 | TDP1 (0.39) | CES2CES1ACHETDP1L3MBTL1 | |
| SCHEMBL25029741 | 0.65 | UNG (0.44) | CES2CES1ACHETDP1UNG | |
| Isophthalic Acid SCHEMBL11135251 | 0.65 | UNG (0.65) | TDP1L3MBTL1ATMUNGALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-10175949-A | — | — | None | — | — | JP | disclosed |
| JP-H10175949-A | EXTRACTION OF HYDROPEROXIDE | SUMITOMO CHEM CO LTD | 1998-06-30 | — | — | JP | disclosed |