Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.35 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.35 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 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 | |
|---|---|---|---|---|
| Hexane SCHEMBL27853321 | 0.97 | TSHR (0.43) | TSHRTHRBALDH1A1EPHX2SMPD1 | |
| Pentane SCHEMBL22150456 | 0.92 | TSHR (0.41) | TSHRTHRBALDH1A1LMNA | |
| Pentane SCHEMBL22150457 | 0.92 | TSHR (0.41) | TSHRTHRBALDH1A1LMNA | |
| SCHEMBL4435959 | 0.89 | TSHR (0.70) | TSHRTHRBALDH1A1LMNA | |
| SCHEMBL28211085 | 0.85 | TSHR (0.52) | TSHRTHRBALDH1A1 | |
| SCHEMBL28210478 | 0.85 | TSHR (0.52) | TSHRTHRBALDH1A1 | |
| SCHEMBL29232116 | 0.85 | TSHR (0.52) | TSHRTHRBALDH1A1 | |
| Propane SCHEMBL27390594 | 0.82 | — | — | |
| SCHEMBL731172 | 0.79 | TSHR (0.47) | TSHRALDH1A1LMNAHSD17B10MEN1 | |
| Nonane SCHEMBL4659307 | 0.78 | TSHR (0.61) | TSHRTHRBALDH1A1DNM1LMNA |
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-4031151-A | Separation of hydrocarbons | EXXON RESEARCH AND ENGINEERING COMPANY (US) | 1977-06-21 | — | — | US | disclosed |