Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 7/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL20350427 | 0.82 | GAA (0.49) | SMN1; SMN2HSD17B10KDM4EMAPK1 | |
| SCHEMBL17662698 | 0.80 | KCNN4 (0.47) | — | |
| SCHEMBL630419 | 0.77 | IDO1 (0.47) | MEN1KMT2A | |
| SCHEMBL6868580 | 0.77 | HDAC3 (0.49) | CYP3A4CASP1PKMSMN1; SMN2ALDH1A1 | |
| SCHEMBL8499982 | 0.75 | CYP2C19 (0.44) | KMT2A | |
| SCHEMBL3112777 | 0.74 | CYP2C19 (0.47) | KMT2A | |
| SCHEMBL7624194 | 0.74 | CASP1 (0.68) | CYP3A4CASP1ALDH1A1 | |
| SCHEMBL1502420 | 0.74 | CYP3A4 (0.50) | CYP3A4PKMSMN1; SMN2ALDH1A1HSD17B10 | |
| Toluene SCHEMBL28927049 | 0.74 | MAPT (0.47) | CYP3A4CASP1SMN1; SMN2ALDH1A1HSD17B10 | |
| SCHEMBL8499984 | 0.73 | ACACB (0.51) | — |
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-1937656-A1 | 7-(2-AMINO-1-HYDROXY-ETHYL)-4-HYDROXYBENZOTHIAZOL-2(3H)-ONE-DERIVATIVES AS BETA 2 ADRENOCEPTOR AGONISTS | AstraZeneca AB (SE) | 2008-07-02 | — | — | EP | disclosed |
| WO-2007027134-A1 | 7-(2-AMINO-1-HYDROXY-ETHYL)-4-HYDROXYBENZOTHIAZOL-2(3H)-ONE-DERIVATIVES AS β2 ADRENOCEPTOR AGONISTS | ASTRAZENECA AB (SE) | 2007-03-08 | — | — | WO | disclosed |