Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MC4R | P32245 | 2/20 | 0.37 |
| ▸ | MC5R | P33032 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | MC3R | P41968 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4590193 | 0.92 | CYP1A2 (0.41) | CYP1A2SIGMAR1HDAC1HDAC8KDM4E | |
| SCHEMBL4589937 | 0.84 | CYP1A2 (0.47) | CYP1A2SIGMAR1HDAC1HDAC8KDM4E | |
| SCHEMBL4517490 | 0.82 | TDP1 (0.44) | CYP1A2MAPK1TDP1 | |
| SCHEMBL4590036 | 0.82 | CYP1A2 (0.47) | CYP1A2SIGMAR1HDAC1HDAC8KDM4E | |
| SCHEMBL869422 | 0.80 | CYP1A2 (0.54) | CYP1A2SIGMAR1HDAC1HDAC8KDM4E | |
| SCHEMBL29546077 | 0.80 | CYP1A2 (0.54) | CYP1A2SIGMAR1HDAC1HDAC8KDM4E | |
| SCHEMBL4589153 | 0.80 | RAB9A (0.39) | CYP1A2SIGMAR1HDAC1HDAC8KDM4E | |
| SCHEMBL27873878 | 0.78 | CYP1A2 (0.51) | CYP1A2SIGMAR1HDAC1HDAC8KDM4E | |
| SCHEMBL10866501 | 0.77 | SIGMAR1 (0.58) | CYP1A2SIGMAR1HDAC1HDAC8MC4R | |
| SCHEMBL14299363 | 0.76 | CYP1A2 (0.53) | CYP1A2SIGMAR1HDAC1HDAC8KDM4E |
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 |