Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.61 |
| ▸ | THRB | P10828 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | DNM1 | Q05193 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Octane SCHEMBL2046131 | 1.00 | TSHR (0.61) | TSHRTHRBTDP1DNM1ALDH1A1 | |
| Decane SCHEMBL10984014 | 1.00 | TSHR (0.61) | TSHRTHRBTDP1DNM1ALDH1A1 | |
| Hexane SCHEMBL8853719 | 0.96 | TSHR (0.67) | TSHRTHRBTDP1DNM1ALDH1A1 | |
| Pentane SCHEMBL8834784 | 0.88 | TSHR (0.67) | TSHRTHRBTDP1DNM1ALDH1A1 | |
| Hexadecane SCHEMBL8539230 | 0.83 | TSHR (0.89) | TSHRTHRBDNM1ALDH1A1LMNA | |
| Charcoal, Activated SCHEMBL3664946 | 0.83 | TSHR (0.89) | TSHRTHRBDNM1ALDH1A1LMNA | |
| Heptane SCHEMBL1169629 | 0.83 | — | — | |
| Tetradecane SCHEMBL7856354 | 0.83 | TSHR (0.89) | TSHRTHRBDNM1ALDH1A1LMNA | |
| Charcoal, Activated SCHEMBL31513512 | 0.83 | TSHR (0.89) | TSHRTHRBDNM1ALDH1A1LMNA | |
| Charcoal, Activated SCHEMBL31557734 | 0.83 | TSHR (0.89) | TSHRTHRBDNM1ALDH1A1LMNA |
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-4177227-A | DILUENTS CAN BE METHYLENE CHLORIDE, HEPTANE, HEXANE, DIMETHYLBUTANE/2,2-/, DICHLOROETHANE/1,1- | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1979-12-04 | — | — | US | disclosed |