Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | GRIK1 | P39086 | 3/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL309762 | 0.88 | CYP3A4 (0.63) | CYP3A4CYP2C9TBXAS1RECQLAKR1C3 | |
| SCHEMBL2918640 | 0.88 | CYP3A4 (0.63) | CYP3A4CYP2C9TBXAS1RECQLAKR1C3 | |
| SCHEMBL57683 | 0.88 | CYP3A4 (0.63) | CYP3A4CYP2C9TBXAS1RECQLAKR1C3 | |
| SCHEMBL5173409 | 0.80 | TBXAS1 (0.58) | CYP3A4CYP2C9TBXAS1RECQLGRIK1 | |
| Methacrylic Acid SCHEMBL10714804 | 0.80 | CYP3A4 (0.54) | CYP3A4CYP2C9TBXAS1RECQLAKR1C3 | |
| Oxirane SCHEMBL15646744 | 0.80 | CYP3A4 (0.54) | CYP3A4CYP2C9TBXAS1RECQLAKR1C3 | |
| (Z)-1,2-Diphenylethene SCHEMBL4230847 | 0.79 | CYP1A2 (0.50) | CYP2C9RECQLGRIK1GRIK2PPARG | |
| (Z)-1,2-Diphenylethene SCHEMBL4230850 | 0.79 | CYP1A2 (0.50) | CYP2C9RECQLGRIK1GRIK2PPARG | |
| SCHEMBL9061442 | 0.78 | TP53 (0.59) | CYP3A4CYP2C9TBXAS1RECQLAKR1C3 | |
| SCHEMBL15955485 | 0.78 | CYP3A4 (0.55) | CYP3A4CYP2C9TBXAS1RECQLAKR1C3 |
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-1922398-A1 | CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2008-05-21 | — | — | EP | disclosed |
| WO-2007028477-A1 | CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2007-03-15 | — | — | WO | disclosed |