Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | KCNJ1 | P48048 | 2/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.49 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | HTT | P42858 | 4/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 5/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL8451427 | 0.91 | TSHR (0.61) | TSHRKCNJ1KMT2AMAPTALDH1A1 | |
| SCHEMBL135651 | 0.86 | TSHR (0.59) | TSHRKCNJ1SIGMAR1KMT2AMAPT | |
| SCHEMBL14397047 | 0.84 | TSHR (0.58) | TSHRKCNJ1SIGMAR1KMT2AMAPT | |
| Hydrochloric Acid SCHEMBL5030930 | 0.84 | TSHR (0.58) | TSHRKCNJ1SIGMAR1KMT2AMAPT | |
| SCHEMBL18913824 | 0.82 | TSHR (0.69) | TSHRKCNJ1SIGMAR1ALDH1A1CYP2C19 | |
| SCHEMBL30758863 | 0.82 | TSHR (0.69) | TSHRKCNJ1SIGMAR1ALDH1A1CYP2C19 | |
| SCHEMBL2850348 | 0.82 | TSHR (0.59) | TSHRKCNJ1SIGMAR1KMT2AMAPT | |
| SCHEMBL11760068 | 0.81 | TSHR (0.54) | TSHRKCNJ1SIGMAR1KMT2AMAPT | |
| SCHEMBL5030925 | 0.81 | TSHR (0.58) | TSHRKCNJ1SIGMAR1KMT2AMAPT | |
| SCHEMBL1527806 | 0.81 | MAPT (0.58) | TSHRKCNJ1SIGMAR1KMT2AMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1997021666-A1 | ARYLETHANOLAMINE DERIVATIVES AND THEIR USE AS AGONISTS OF ATYPICAL BETA-ADRENOCEPTORS | GLAXO GROUP LIMITED (GB) | 1997-06-19 | — | — | WO | disclosed |