Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 6/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.46 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 2/20 | 0.46 |
| ▸ | NCEH1 | Q6PIU2 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP8 | Q96LD8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9848137 | 0.83 | CTNNB1 (0.54) | ALDH1A1FFAR1CES1GAAMAPT | |
| SCHEMBL3742719 | 0.81 | FFAR1 (0.46) | FFAR1HDAC8HDAC1 | |
| SCHEMBL1256723 | 0.73 | HPGD (0.66) | KEAP1ALDH1A1FFAR1CES1GAA | |
| SCHEMBL11304333 | 0.71 | TDP1 (0.62) | KEAP1ALDH1A1FFAR1GAAMAPT | |
| SCHEMBL15524969 | 0.71 | TDP1 (0.77) | KEAP1ALDH1A1FFAR1CES1GAA | |
| SCHEMBL30572 | 0.71 | TDP1 (0.77) | KEAP1ALDH1A1FFAR1CES1GAA | |
| SCHEMBL28251466 | 0.71 | TDP1 (0.77) | KEAP1ALDH1A1FFAR1CES1GAA | |
| SCHEMBL22430810 | 0.71 | TDP1 (0.56) | ALDH1A1MAPTNPC1RAB9ATDP1 | |
| Phenyl Propionic Acid SCHEMBL6534964 | 0.71 | KEAP1 (0.95) | KEAP1ALDH1A1FFAR1MAPTTDP1 | |
| SCHEMBL112293 | 0.71 | — | — |
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-7010851-A | — | — | None | — | — | JP | disclosed |
| JP-H0710851-A | AMINOALCOHOL DERIVATIVE AND ITS USE | MITSUI TOATSU CHEM INC | 1995-01-13 | — | — | JP | disclosed |