Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.59 |
| ▸ | CNR2 | P34972 | 5/20 | 0.58 |
| ▸ | CNR1 | P21554 | 5/20 | 0.58 |
| ▸ | CDC25B | P30305 | 3/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | PRNP | P04156 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3748729 | 0.94 | CNR2 (0.54) | CYP1A2CNR2CNR1CDC25BCYP2A6 | |
| SCHEMBL14124749 | 0.89 | CDC25B (0.64) | CNR2CNR1CDC25BPRNPCYP3A4 | |
| SCHEMBL13625861 | 0.89 | CDC25B (0.61) | CYP1A2CNR2CNR1CDC25BCYP2A6 | |
| SCHEMBL12748835 | 0.88 | CYP1A2 (0.50) | CYP1A2CNR2CNR1LMNAPOLB | |
| SCHEMBL13045513 | 0.87 | CNR2 (0.49) | CYP1A2CNR2CNR1CDC25BLMNA | |
| SCHEMBL669648 | 0.84 | CYP1A2 (0.56) | CYP1A2CNR2CNR1CDC25BCYP2A6 | |
| SCHEMBL31347531 | 0.84 | CYP1A2 (0.56) | CYP1A2CNR2CNR1CYP2A6CYP3A4 | |
| SCHEMBL405225 | 0.84 | CYP1A2 (0.56) | CYP1A2CNR2CNR1CYP2A6CYP3A4 | |
| SCHEMBL7829452 | 0.84 | CYP1A2 (0.56) | CYP1A2CNR2CNR1CYP2A6CYP3A4 | |
| SCHEMBL14124787 | 0.84 | MYC (0.51) | CYP1A2CNR2CNR1CDC25BPRNP |
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-6376457-B1 | 1-(1,1-DIETHOXYETHYL)-2,4-DIMETHYL BENZENE; DETERGENT, CLEANER, FABRIC SOFTENER, TEXTILE TREATMENT OR COSMETIC COMPOSITION. | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2002-04-23 | — | — | US | disclosed |