Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.54 |
| ▸ | NPC1 | O15118 | 5/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.53 |
| ▸ | CNR1 | P21554 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | ESRRG | P62508 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2824601 | 0.88 | NPC1 (0.61) | RAB9ANPC1SMN1; SMN2CNR1MEN1 | |
| SCHEMBL1206065 | 0.86 | TRPV1 (0.55) | RAB9ANPC1SMN1; SMN2TRPV1CNR1 | |
| SCHEMBL2853369 | 0.85 | RAB9A (0.65) | RAB9ANPC1SMN1; SMN2CNR1MEN1 | |
| SCHEMBL12069954 | 0.83 | NPC1 (0.78) | RAB9ANPC1SMN1; SMN2TRPV1MEN1 | |
| SCHEMBL1206058 | 0.83 | TRPV1 (0.49) | RAB9ANPC1SMN1; SMN2TRPV1MEN1 | |
| SCHEMBL2827311 | 0.80 | KMT2A (0.72) | RAB9ANPC1SMN1; SMN2CNR1MEN1 | |
| SCHEMBL14860031 | 0.80 | MTOR (0.72) | RAB9ANPC1SMN1; SMN2TRPV1CNR1 | |
| SCHEMBL13167593 | 0.79 | TRPV1 (0.71) | RAB9ANPC1SMN1; SMN2TRPV1MEN1 | |
| SCHEMBL2849248 | 0.79 | MEN1 (0.62) | RAB9ANPC1SMN1; SMN2CNR1MEN1 | |
| SCHEMBL2823579 | 0.79 | KMT2A (0.60) | RAB9ANPC1SMN1; SMN2CNR1MEN1 |
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 |