Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.30 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL107545 | 0.83 | CES2 (0.39) | ALDH1A1CA2CES2CES1FFAR3 | |
| SCHEMBL104701 | 0.83 | — | — | |
| Methyl Isobutyl Ketone SCHEMBL22321104 | 0.81 | ALDH1A1 (0.67) | ALDH1A1TDP1CYP2C19CA2CES2 | |
| SCHEMBL7540967 | 0.81 | — | — | |
| SCHEMBL27601579 | 0.81 | — | — | |
| SCHEMBL4984202 | 0.81 | — | — | |
| SCHEMBL270159 | 0.81 | — | — | |
| SCHEMBL28649278 | 0.77 | ALDH1A1 (0.52) | ALDH1A1TDP1CYP2C19CA2CES2 | |
| SCHEMBL7520831 | 0.77 | CYP2C19 (0.46) | ALDH1A1TDP1CYP2C19CA2CES2 | |
| SCHEMBL107548 | 0.77 | CYP2C19 (0.46) | ALDH1A1TDP1CYP2C19CA2ACHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-0984683-A2 | MEANS AMD METHOD FOR PEST CONTROL | OCTROOIBUREAU KISCH N.V. (AN) | 2000-03-15 | — | — | EP | disclosed |
| WO-1998053678-A2 | MEANS AMD METHOD FOR PEST CONTROL | OCTROOIBUREAU KISCH N. V. (AN) | 1998-12-03 | — | — | WO | disclosed |