Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL1030197 | 0.93 | TSHR (0.43) | TSHRLMNATHRBALDH1A1TDP1 | |
| Iodide SCHEMBL9465834 | 0.90 | TSHR (0.40) | TSHRLMNATHRBALDH1A1TDP1 | |
| SCHEMBL2328972 | 0.84 | TSHR (0.50) | TSHRLMNATHRBALDH1A1 | |
| Dimethylamine SCHEMBL11697302 | 0.84 | TSHR (0.36) | TSHRLMNATHRBALDH1A1 | |
| Benzene SCHEMBL28267181 | 0.84 | TSHR (0.35) | TSHRLMNATHRB | |
| SCHEMBL11417390 | 0.83 | TSHR (0.47) | TSHRLMNATHRBALDH1A1 | |
| SCHEMBL11076226 | 0.80 | TSHR (0.53) | TSHRLMNATHRBALDH1A1 | |
| SCHEMBL6275141 | 0.80 | TSHR (0.53) | TSHRLMNATHRBALDH1A1 | |
| SCHEMBL2553636 | 0.80 | TSHR (0.53) | TSHRLMNATHRBALDH1A1 | |
| SCHEMBL11434423 | 0.79 | TSHR (0.32) | TSHRLMNATHRB |
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 |
|---|---|---|---|---|---|---|---|
| US-5286901-A | Prescursors for and synthesis of mono- and difunctionalized acetylenes and difunctional 1,3-diynes | UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) | 1994-02-15 | — | — | US | disclosed |