Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CES2 | O00748 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL808949 | 0.87 | FAAH (0.35) | CES2 | |
| SCHEMBL820956 | 0.83 | — | — | |
| SCHEMBL28831166 | 0.67 | — | — | |
| SCHEMBL421594 | 0.66 | TSHR (0.37) | ALDH1A1TSHR | |
| SCHEMBL3355262 | 0.65 | TSHR (0.35) | ALDH1A1TSHR | |
| SCHEMBL1751456 | 0.64 | ALDH1A1 (0.30) | ALDH1A1TSHR | |
| SCHEMBL385253 | 0.64 | TSHR (0.43) | ALDH1A1TSHR | |
| SCHEMBL1029360 | 0.64 | TSHR (0.43) | ALDH1A1TSHR | |
| SCHEMBL124655 | 0.64 | TSHR (0.43) | ALDH1A1TSHR | |
| SCHEMBL437089 | 0.63 | TSHR (0.33) | ALDH1A1TSHR |
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-1776119-B9 | TETRAHYDRO-NAPHTHALENE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS | GLAXO GROUP LTD (GB) | 2012-06-13 | — | — | EP | claimed |
| EP-1776119-B1 | TETRAHYDRO-NAPHTHALENE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS | GLAXO GROUP LTD (GB) | 2012-01-18 | — | — | EP | claimed |