Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11840117 | 1.00 | CYP3A4 (0.38) | CYP3A4ALDH1A1LMNATDP1ZDHHC20 | |
| SCHEMBL11844493 | 0.89 | ALDH1A1 (0.51) | CYP3A4ALDH1A1LMNATDP1ZDHHC20 | |
| SCHEMBL11844489 | 0.89 | ALDH1A1 (0.51) | CYP3A4ALDH1A1LMNATDP1ZDHHC20 | |
| SCHEMBL11845237 | 0.87 | ZDHHC20 (0.38) | CYP3A4ALDH1A1LMNATDP1ZDHHC20 | |
| SCHEMBL11845229 | 0.87 | ZDHHC20 (0.38) | CYP3A4ALDH1A1LMNATDP1ZDHHC20 | |
| SCHEMBL11846847 | 0.82 | ZDHHC20 (0.35) | ZDHHC20 | |
| SCHEMBL11846853 | 0.82 | ZDHHC20 (0.35) | ZDHHC20 | |
| SCHEMBL11839838 | 0.80 | ALOX15 (0.43) | ALDH1A1ZDHHC20TSHR | |
| SCHEMBL11839821 | 0.80 | ALOX15 (0.43) | ALDH1A1ZDHHC20TSHR | |
| SCHEMBL11846925 | 0.80 | ZDHHC20 (0.40) | CYP3A4ZDHHC20CYP1A2CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-3966780-A | PESTICIDES, INSECTICIDES | HOFFMANN-LA ROCHE INC. (US) | 1976-06-29 | — | — | US | disclosed |