Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.58 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.52 |
| ▸ | ADH1B | P00325 | 1/20 | 0.52 |
| ▸ | ADH1C | P00326 | 1/20 | 0.52 |
| ▸ | ADH1A | P07327 | 1/20 | 0.52 |
| ▸ | ADH4 | P08319 | 1/20 | 0.52 |
| ▸ | ADH7 | P40394 | 1/20 | 0.52 |
| ▸ | DNM1 | Q05193 | 8/20 | 0.50 |
| ▸ | FAAH | O00519 | 2/20 | 0.50 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| Decane SCHEMBL27459125 | 1.00 | TSHR (0.58) | TSHRTHRBEPHX1ADH1BADH1C | |
| Octane SCHEMBL11450768 | 1.00 | TSHR (0.58) | TSHRTHRBEPHX1ADH1BADH1C | |
| Hexane SCHEMBL11778911 | 0.96 | — | — | |
| Pentane SCHEMBL28075610 | 0.89 | — | — | |
| Dodecylamine SCHEMBL28100936 | 0.88 | DNM1 (0.72) | TSHRTHRBEPHX1DNM1MEN1 | |
| Formamide SCHEMBL28100937 | 0.88 | DNM1 (0.72) | TSHRTHRBEPHX1DNM1MEN1 | |
| Decylamine SCHEMBL28101058 | 0.88 | DNM1 (0.72) | TSHRTHRBEPHX1DNM1MEN1 | |
| Docosanol SCHEMBL8945651 | 0.86 | TSHR (0.68) | TSHRTHRBEPHX1ADH1BADH1C | |
| Formamide SCHEMBL27582736 | 0.86 | TSHR (0.46) | TSHRTHRBEPHX1ADH1BADH1C | |
| Formamide SCHEMBL28172338 | 0.86 | TSHR (0.46) | TSHRTHRBEPHX1ADH1BADH1C |
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-1481377-A | Cyclic beta-amino acid derivatives as inhibitors of matrix metalloproteinases and TNF-alpha | ����˹�ж�-����˹˹����ҩƷ��˾ | 2004-03-10 | — | — | CN | disclosed |