Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19709350 | 1.00 | TSHR (0.36) | TSHRHTR6ADRA2AADRA2BADRA2C | |
| SCHEMBL1783525 | 0.83 | TSHR (0.47) | TSHRHTR6ADRA2AADRA2BADRA2C | |
| SCHEMBL10053832 | 0.80 | CA5A (0.45) | — | |
| Iodide SCHEMBL31463955 | 0.79 | TSHR (0.44) | TSHRHTR6ADRA2AADRA2BADRA2C | |
| SCHEMBL10053831 | 0.78 | TSHR (0.48) | TSHRADRA2AADRA2BADRA2C | |
| SCHEMBL20987906 | 0.75 | TSHR (0.50) | TSHRADRA2AADRA2BADRA2C | |
| SCHEMBL13198271 | 0.71 | RAPGEF4 (0.42) | TSHRHTR6 | |
| SCHEMBL22852090 | 0.69 | KIF11 (0.52) | TSHRADRA2AADRA2BADRA2C | |
| SCHEMBL128139 | 0.69 | LMNA (0.50) | TSHRADRA2AADRA2BADRA2C | |
| SCHEMBL1689742 | 0.69 | TTR (0.36) | TSHR |
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-2020263761-A1 | IRON(III) AND GALLIUM(III) METAL ORGANIC POLYHEDRA, METHODS OF MAKING SAME, AND USES THEREOF | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) | 2020-12-30 | — | — | WO | disclosed |