Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | RECQL | P46063 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2823927 | 1.00 | SMN1; SMN2 (0.59) | SMN1; SMN2NPC1RAB9ATP53MEN1 | |
| Nitrobenzene SCHEMBL30072512 | 0.89 | NPC1 (0.73) | SMN1; SMN2NPC1RAB9ATP53MEN1 | |
| Nitrobenzene SCHEMBL30072159 | 0.89 | NPC1 (0.73) | SMN1; SMN2NPC1RAB9ATP53MEN1 | |
| Nitrobenzene SCHEMBL30072514 | 0.89 | NPC1 (0.73) | SMN1; SMN2NPC1RAB9ATP53MEN1 | |
| SCHEMBL11507860 | 0.88 | CYP2D6 (0.56) | SMN1; SMN2NPC1RAB9ATP53MEN1 | |
| SCHEMBL11511887 | 0.85 | MEN1 (0.57) | SMN1; SMN2NPC1RAB9ATP53MEN1 | |
| SCHEMBL9178787 | 0.84 | SMN1; SMN2 (0.51) | SMN1; SMN2NPC1RAB9ATP53MEN1 | |
| SCHEMBL9178785 | 0.84 | SMN1; SMN2 (0.51) | SMN1; SMN2NPC1RAB9ATP53MEN1 | |
| SCHEMBL8986873 | 0.82 | TSHR (0.54) | SMN1; SMN2NPC1RAB9ATP53MEN1 | |
| SCHEMBL8986879 | 0.82 | TSHR (0.54) | SMN1; SMN2NPC1RAB9ATP53MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2254860-A1 | DERIVATIVES OF 4-(2-AMINO-1-HYDROXYETHYL) PHENOL AS AGONISTS OF THE B2 ADRENERGIC RECEPTOR | Almirall, S.A. (ES) | 2010-12-01 | — | — | EP | disclosed |
| WO-2009106351-A1 | DERIVATIVES OF 4-(2-AMINO-1-HYDROXYETHYL) PHENOL AS AGONISTS OF THE B2 ADRENERGIC RECEPTOR | ALMIRALL, S.A. (ES) | 2009-09-03 | — | — | WO | disclosed |
| EP-2096105-A1 | Derivatives of 4-(2-amino-1-hydroxyethyl)phenol as agonists of the b2 adrenergic receptor | Laboratorios Almirall, S.A. (ES) | 2009-09-02 | — | — | EP | disclosed |