Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.47 |
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 3/20 | 0.42 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28050756 | 0.83 | TAAR1 (0.50) | TAAR1IDO1ACHECTBP2POLB | |
| SCHEMBL20204821 | 0.83 | TAAR1 (0.50) | TAAR1IDO1ACHECTBP2POLB | |
| SCHEMBL15178101 | 0.82 | TAAR1 (0.46) | TAAR1IDO1ACHECTBP2POLB | |
| SCHEMBL16067599 | 0.82 | TAAR1 (0.46) | TAAR1IDO1ACHECTBP2POLB | |
| SCHEMBL19232414 | 0.82 | TAAR1 (0.48) | TAAR1IDO1ACHENR3C1PGR | |
| SCHEMBL8257853 | 0.82 | TAAR1 (0.48) | TAAR1IDO1ACHECTBP2POLB | |
| SCHEMBL14997302 | 0.82 | TAAR1 (0.48) | TAAR1IDO1ACHECTBP2POLB | |
| SCHEMBL11827945 | 0.80 | TAAR1 (0.52) | TAAR1IDO1ACHECTBP2POLB | |
| SCHEMBL9631389 | 0.80 | TAAR1 (0.47) | TAAR1IDO1ACHECTBP2POLB | |
| SCHEMBL26173261 | 0.80 | TAAR1 (0.47) | TAAR1IDO1ACHECTBP2POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-101218203-B | Fluorinated derivatives of 4- (2-amino-1-hydroxyethyl) phenol as beta 2 adrenoreceptor agonists | ALMIRALL SA | 2012-05-30 | — | — | CN | disclosed |
| CN-101218203-A | Derivatives of 4-(2-amino-1-hydroxyethyl) phenol as agonists of the ss2 adrenergic receptor | ALMIRALL PRODESFARMA SA (ES) | 2008-07-09 | — | — | CN | disclosed |