Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19856519 | 0.85 | SMN1; SMN2 (0.43) | CYP1A2CYP2D6CYP2C19SLC7A5CYP4F2 | |
| SCHEMBL24948270 | 0.84 | TP53 (0.39) | CYP1A2CYP2D6CYP2C19SLC7A5LOXL2 | |
| SCHEMBL7946046 | 0.83 | CYP1A2 (0.44) | CYP1A2CYP2D6CYP2C19SLC7A5LOXL2 | |
| SCHEMBL5374679 | 0.83 | CYP1A2 (0.47) | CYP1A2CYP2D6CYP2C19SLC7A5LOXL2 | |
| SCHEMBL5373190 | 0.83 | CYP1A2 (0.59) | CYP1A2CYP2D6CYP2C19SLC7A5LOXL2 | |
| SCHEMBL19856520 | 0.81 | PLA2G4B (0.44) | — | |
| SCHEMBL16421103 | 0.79 | SLC7A5 (0.52) | CYP1A2CYP2D6CYP2C19SLC7A5LOXL2 | |
| SCHEMBL110296 | 0.78 | SLC7A5 (0.58) | CYP1A2CYP2D6CYP2C19SLC7A5LOXL2 | |
| SCHEMBL7946047 | 0.78 | KMT2A (0.46) | CYP1A2CYP2D6CYP2C19SLC7A5KDM4E | |
| SCHEMBL3096149 | 0.76 | CYP1A2 (0.42) | CYP1A2CYP2D6CYP2C19SLC7A5LOXL2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7208545-B1 | Selected cyclohexane -1,3-and -1,4-dicarboxylic acid esters | BASF AKTIENGESELLSCHAFT (DE) | 2007-04-24 | — | — | US | claimed |
| EP-1194396-B1 | SELECTED CYCLOHEXANE-1,3- AND 1,4-DICARBOXYLIC ACID ESTERS | BASF AG (DE) | 2005-11-09 | — | — | EP | claimed |
| US-7208545-B1 | Selected cyclohexane -1,3-and -1,4-dicarboxylic acid esters | BASF AKTIENGESELLSCHAFT (DE) | 2007-04-24 | — | — | US | disclosed |