Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 2/20 | 0.65 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.65 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.65 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.65 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.65 |
| ▸ | PKM | P14618 | 1/20 | 0.65 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.65 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.65 |
| ▸ | HTR2C | P28335 | 1/20 | 0.65 |
| ▸ | HRH1 | P35367 | 1/20 | 0.65 |
| ▸ | DRD3 | P35462 | 1/20 | 0.65 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.65 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.64 |
| ▸ | BLM | P54132 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL29711062 | 0.98 | SMN1; SMN2 (0.66) | ADRA1DADRA1AADRA1BCHRNA4CYP1A2 | |
| Acetic Acid SCHEMBL8961488 | 0.93 | ADRA1D (0.69) | ADRA1DADRA1AADRA1BCHRNA4CYP1A2 | |
| Acetic Acid SCHEMBL11172121 | 0.92 | SMN1; SMN2 (0.70) | ADRA1DADRA1AADRA1BCHRNA4CYP1A2 | |
| Moxisylyte SCHEMBL6398989 | 0.88 | ADRA1D (0.88) | ADRA1DADRA1AADRA1BCHRNA4CYP1A2 | |
| Benzoic Acid SCHEMBL11129389 | 0.87 | ADRA1D (0.58) | ADRA1DADRA1AADRA1BCHRNA4CYP1A2 | |
| SCHEMBL18272003 | 0.83 | ADRA1D (0.50) | ADRA1DADRA1AADRA1BCHRNA4CYP1A2 | |
| SCHEMBL11132329 | 0.82 | CYP1A2 (0.61) | ADRA1DADRA1AADRA1BCHRNA4CYP1A2 | |
| SCHEMBL10570677 | 0.82 | ADRA1D (0.56) | ADRA1DADRA1AADRA1BCHRNA4CYP1A2 | |
| SCHEMBL10641890 | 0.81 | ADRA1D (0.49) | ADRA1DADRA1AADRA1BCHRNA4CYP1A2 | |
| SCHEMBL10671728 | 0.81 | ADRA1D (0.49) | ADRA1DADRA1AADRA1BCHRNA4CYP1A2 |
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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1018879-B1 | NITROSATED AND NITROSYLATED ALPHA-ADRENERGIC RECEPTOR ANTAGONIST COMPOUNDS, COMPOSITIONS AND THEIR USES | NITROMED INC (US) | 2007-08-01 | — | — | EP | claimed |
| EP-0031184-B1 | PROCESS FOR THE PREPARATION OF 4-(2-(DIMETHYLAMINO)-ETHOXY)-2-METHYL-5-(1-METHYLETHYL)-PHENOL ESTERS AND THEIR SALTS | BLASCHIM S.p.A. (IT) | 1985-07-10 | — | — | EP | claimed |
| JP-58126844-A | — | — | None | — | — | JP | disclosed |
| JP-62111952-A | — | — | None | — | — | JP | disclosed |
| JP-60115555-A | — | — | None | — | — | JP | disclosed |
| JP-62053947-A | — | — | None | — | — | JP | disclosed |
| JP-58167551-A | — | — | None | — | — | JP | disclosed |
| JP-63063644-A | — | — | None | — | — | JP | disclosed |
| JP-1228945-A | — | — | None | — | — | JP | disclosed |
| JP-63141948-A | — | — | None | — | — | JP | disclosed |
| JP-57206643-A | — | — | None | — | — | JP | disclosed |
| JP-S5849342-A | PREPARATION OF 5-(2-(DIMETHYLAMINO)ETHOXY)CARVACROL | FUJIREBIO INC | 1983-03-23 | — | — | JP | disclosed |
| JP-S5849343-A | PREPARATION OF 5-(2-(DIMETHYLAMINO)ETHOXY)CARVACROL | FUJIREBIO INC | 1983-03-23 | — | — | JP | disclosed |
| JP-S5835149-A | PREPARATION OF 5-(2-(DIMETHYLAMINO)ETHOXY)-CARVACROL | FUJIREBIO INC | 1983-03-01 | — | — | JP | disclosed |
| JP-S5835149-A | PREPARATION OF 5-(2-(DIMETHYLAMINO)ETHOXY)-CARVACROL | FUJIREBIO INC | 1983-03-01 | — | — | JP | disclosed |
| JP-S57206643-A | PREPARATION OF 5-(2-(DIMETHYLAMINO)ETHOXY)CARVACROL ACETATE | FUJIREBIO INC | 1982-12-18 | — | — | JP | disclosed |
| US-4336396-A | Process for the preparation of 4-[2-(dimethylamino)-ethoxy]2-methyl-5-(1-methylethyl)-phenol esters and their salts | BLASINACHIM S.P.A. (IT) | 1982-06-22 | — | — | US | disclosed |
| JP-S5798243-A | PREPARATION OF 5-(N-METHYLAMINOETHOXY)CARVACROL | FUJIREBIO INC | 1982-06-18 | — | — | JP | disclosed |
| EP-0031184-A1 | Process for the preparation of 4-(2-(dimethylamino)-ethoxy)-2-methyl-5-(1-methylethyl)-phenol esters and their salts | BLASCHIM S.p.A. (IT) | 1981-07-01 | — | — | EP | disclosed |
| EP-0031184-A1 | Process for the preparation of 4-(2-(dimethylamino)-ethoxy)-2-methyl-5-(1-methylethyl)-phenol esters and their salts | BLASCHIM S.p.A. (IT) | 1981-07-01 | — | — | EP | disclosed |