Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.45 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.45 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | PPARD | Q03181 | 2/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11265947 | 1.00 | CYP3A4 (0.50) | CYP3A4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL987061 | 0.84 | ALOX15 (0.47) | MAOBPPARDMTNR1AMTNR1B | |
| SCHEMBL11257786 | 0.80 | CYP3A4 (0.47) | CYP3A4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL11257782 | 0.80 | CYP3A4 (0.47) | CYP3A4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL11286590 | 0.78 | CHRNB2 (0.47) | CYP3A4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL11284331 | 0.76 | CHRNB2 (0.42) | CYP3A4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL2727598 | 0.75 | CHRNB2 (0.50) | CYP3A4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL11296673 | 0.75 | CYP3A4 (0.53) | CYP3A4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL11269344 | 0.74 | ALOX15 (0.47) | MAOBPPARDMTNR1AMTNR1B | |
| SCHEMBL8082700 | 0.74 | CYP3A4 (0.59) | CYP3A4CHRNB2CHRNA4CHRNB4CHRNA3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4340765-A | 4-Phenoxy-2-butene derivatives as plant growth regulators | MALLINCKRODT BAKER, INC. | 1982-07-20 | — | — | US | disclosed |
| EP-0046282-A2 | 4-Phenoxy-2-butene derivatives and their use as plant growth regulators | J.T. Baker Chemical Co. (US) | 1982-02-24 | — | — | EP | disclosed |