Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.78 |
| ▸ | THRB | P10828 | 1/20 | 0.78 |
| ▸ | LMNA | P02545 | 3/20 | 0.67 |
| ▸ | SLC22A1 | O15245 | 3/20 | 0.54 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | DNM1 | Q05193 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
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 SCHEMBL48489 | 1.00 | — | — | |
| Hexane SCHEMBL179759 | 1.00 | — | — | |
| Dodecane SCHEMBL136208 | 0.94 | TSHR (0.89) | TSHRTHRBLMNASLC22A1DNM1 | |
| Octane SCHEMBL5861446 | 0.94 | TSHR (0.89) | TSHRTHRBLMNASLC22A1DNM1 | |
| Decane SCHEMBL6264949 | 0.94 | TSHR (0.89) | TSHRTHRBLMNASLC22A1DNM1 | |
| Nonane SCHEMBL525117 | 0.94 | TSHR (0.89) | TSHRTHRBLMNASLC22A1DNM1 | |
| Hexane SCHEMBL5180002 | 0.94 | — | — | |
| Heptane SCHEMBL265284 | 0.94 | — | — | |
| Undecane SCHEMBL4210309 | 0.94 | TSHR (0.89) | TSHRTHRBLMNASLC22A1DNM1 | |
| Decane SCHEMBL21694435 | 0.94 | TSHR (0.89) | TSHRTHRBLMNASLC22A1DNM1 |
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-6075167-A | CATALYTIC HYDROGENATION IN THE PRESENCE OF A RUTHENIUM CATALYST AND METAL NITRITE; BY-PRODUCTS INHIBITION; POLYURETHANE PREPARED FROM CYCLOALIPHATIC DIAMINE IS STABLE AGAINST LIGHT AND AIR, STRUCTURALLY FLEXIBLE | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2000-06-13 | — | — | US | disclosed |