Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 4/20 | 0.47 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CPN1 | P15169 | 1/20 | 0.38 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MLYCD | O95822 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27784974 | 0.86 | ALDH1A1 (0.47) | HTR2CPBRM1ALDH1A1LMNATP53 | |
| SCHEMBL3930203 | 0.80 | HTR2C (0.42) | HTR2CALDH1A1LMNATP53SMN1; SMN2 | |
| SCHEMBL3933066 | 0.79 | HTR2C (0.47) | HTR2CALDH1A1LMNATP53SMN1; SMN2 | |
| SCHEMBL578453 | 0.79 | ALDH1A1 (0.47) | HTR2CALDH1A1LMNATP53SMN1; SMN2 | |
| SCHEMBL5262282 | 0.79 | MTNR1A (0.44) | HTR2CALDH1A1LMNATP53SMN1; SMN2 | |
| SCHEMBL16934132 | 0.79 | ALDH1A1 (0.47) | HTR2CALDH1A1LMNATP53SMN1; SMN2 | |
| SCHEMBL2543696 | 0.79 | ALDH1A1 (0.63) | HTR2CALDH1A1LMNATP53SMN1; SMN2 | |
| SCHEMBL3063250 | 0.79 | ADRB2 (0.37) | HTR2CPBRM1ALDH1A1LMNATP53 | |
| SCHEMBL3922657 | 0.78 | MEN1 (0.45) | HTR2CALDH1A1LMNATP53SMN1; SMN2 | |
| SCHEMBL77791 | 0.77 | ACHE (0.47) | HTR2CALDH1A1LMNATP53SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |