Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 8/20 | 0.45 |
| ▸ | CA2 | P00918 | 8/20 | 0.45 |
| ▸ | STS | P08842 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 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 | |
|---|---|---|---|---|
| SCHEMBL30489949 | 1.00 | THRB (0.46) | THRBCA1CA2STSGAA | |
| SCHEMBL30489953 | 1.00 | THRB (0.46) | THRBCA1CA2STSGAA | |
| SCHEMBL12073740 | 0.91 | ALDH1A1 (0.40) | THRBCA1CA2STSGAA | |
| SCHEMBL30489951 | 0.84 | CA1 (0.48) | THRBCA1CA2STSGAA | |
| SCHEMBL11609107 | 0.79 | ALDH1A1 (0.34) | ALDH1A1HDAC4HDAC1HDAC6 | |
| SCHEMBL16622189 | 0.79 | EPHX1 (0.55) | CA1CA2STSALDH1A1 | |
| SCHEMBL29800073 | 0.79 | THRB (0.63) | THRBCA1CA2STSGAA | |
| SCHEMBL1169288 | 0.78 | EPHX1 (0.64) | CA1CA2STSALDH1A1 | |
| SCHEMBL10619817 | 0.78 | EPHX1 (0.64) | CA1CA2STSALDH1A1 | |
| SCHEMBL30985235 | 0.78 | CA3 (0.52) | THRBCA1CA2STSGAA |
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-104130151-B | A kind of fixed bed catalyst prepares the method for fluorine carbon alkylamide | 陕西延长石油（集团）有限责任公司 | 2016-08-24 | — | — | CN | disclosed |