Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 4/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | GABBR2 | O75899 | 3/20 | 0.45 |
| ▸ | GABBR1 | Q9UBS5 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11159850 | 1.00 | CYP2C9 (0.54) | CYP2C9CYP2D6MEN1KMT2ACYP2C19 | |
| SCHEMBL11159549 | 0.95 | CYP2C9 (0.58) | CYP2C9CYP2D6MEN1KMT2ACYP2C19 | |
| SCHEMBL12611759 | 0.91 | ESR1 (0.45) | CYP2C9CYP2D6MEN1KMT2ACYP2C19 | |
| SCHEMBL1341465 | 0.91 | ESR1 (0.45) | CYP2C9CYP2D6MEN1KMT2ACYP2C19 | |
| SCHEMBL11444487 | 0.89 | ESR1 (0.44) | CYP2C9CYP2D6MEN1KMT2ACYP2C19 | |
| SCHEMBL11151216 | 0.89 | MEN1 (0.49) | CYP2C9CYP2D6MEN1KMT2ACYP2C19 | |
| SCHEMBL11153133 | 0.87 | MEN1 (0.42) | CYP2C9CYP2D6MEN1KMT2ACYP2C19 | |
| SCHEMBL11155181 | 0.87 | MEN1 (0.45) | CYP2C9CYP2D6MEN1KMT2ACYP2C19 | |
| SCHEMBL11156216 | 0.86 | KMT2A (0.50) | CYP2C9CYP2D6MEN1KMT2ACYP2C19 | |
| SCHEMBL11157245 | 0.86 | KMT2A (0.53) | CYP2C9CYP2D6MEN1KMT2ACYP2C19 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0270830-A1 | Method for regulating plant growth using polysubstituted butyric acids, esters and derivatives thereof | AMERICAN CYANAMID COMPANY (US) | 1988-06-15 | — | — | EP | claimed |
| US-4224052-A | Polysubstituted butanoic acids, esters and derivatives thereof utilizing the same as herbicides | AMERICAN CYANAMID COMPANY (US) | 1980-09-23 | — | — | US | claimed |
| EP-0270830-A1 | Method for regulating plant growth using polysubstituted butyric acids, esters and derivatives thereof | AMERICAN CYANAMID COMPANY (US) | 1988-06-15 | — | — | EP | disclosed |
| US-4383848-A | Polysubstituted butanoic acids, esters and derivatives thereof utilizing the same as herbicides | AMERICAN CYANAMID COMPANY (US) | 1983-05-17 | — | — | US | disclosed |
| US-4313754-A | Polysubstituted butanoic acids, esters and derivatives thereof utilizing the same as herbicides | AMERICAN CYANAMID COMPANY (US) | 1982-02-02 | — | — | US | disclosed |
| US-4224052-A | Polysubstituted butanoic acids, esters and derivatives thereof utilizing the same as herbicides | AMERICAN CYANAMID COMPANY (US) | 1980-09-23 | — | — | US | disclosed |
| EP-0005341-A2 | Polysubstituted butanoic acids, esters and derivatives thereof useful as herbicides, Compositions containing them and their use | AMERICAN CYANAMID COMPANY (US) | 1979-11-14 | — | — | EP | disclosed |