Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.56 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | ADH1C | P00326 | 3/20 | 0.48 |
| ▸ | ADH1A | P07327 | 3/20 | 0.48 |
| ▸ | ADH4 | P08319 | 3/20 | 0.48 |
| ▸ | ADH1B | P00325 | 2/20 | 0.48 |
| ▸ | ADH7 | P40394 | 2/20 | 0.48 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.48 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.48 |
| ▸ | FAAH | O00519 | 2/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 3/20 | 0.39 |
| ▸ | CES1 | P23141 | 3/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Heptane SCHEMBL1975945 | 1.00 | TSHR (0.56) | TSHRTHRBADH1CADH1AADH4 | |
| Octane SCHEMBL8523622 | 1.00 | TSHR (0.56) | TSHRTHRBADH1CADH1AADH4 | |
| Dodecane SCHEMBL28219621 | 1.00 | TSHR (0.56) | TSHRTHRBADH1CADH1AADH4 | |
| Decane SCHEMBL27095057 | 1.00 | TSHR (0.56) | TSHRTHRBADH1CADH1AADH4 | |
| Hexane SCHEMBL913216 | 0.97 | TSHR (0.60) | TSHRTHRBADH1CADH1AADH4 | |
| Pentane SCHEMBL28217044 | 0.90 | TSHR (0.60) | TSHRTHRBADH1CADH1AADH4 | |
| Pentane SCHEMBL28141221 | 0.88 | TSHR (0.56) | TSHRTHRBADH1CADH1AADH4 | |
| Octanol SCHEMBL27660517 | 0.87 | TSHR (0.62) | TSHRTHRBADH1CADH1AADH4 | |
| Dimethylformamide SCHEMBL28799762 | 0.87 | TSHR (0.43) | TSHRTHRBADH1CADH1AADH4 | |
| Dimethylformamide SCHEMBL28261689 | 0.87 | TSHR (0.43) | TSHRTHRBADH1CADH1AADH4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106967113-A | Platelet activating factor derivative and its synthetic method | 西北农林科技大学 | 2017-07-21 | — | — | CN | disclosed |