Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA5A | P35218 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL29215267 | 0.80 | MAPT (0.48) | MAPTKMT2ACYP1A2CYP2D6KCNN4 | |
| SCHEMBL17545281 | 0.80 | CA1 (0.54) | MAPTKMT2ACYP1A2CYP2D6KCNN4 | |
| SCHEMBL5140207 | 0.80 | NR3C2 (0.44) | MAPTKMT2ACYP1A2CYP2D6KCNN4 | |
| SCHEMBL27348750 | 0.78 | NR3C2 (0.47) | MAPTKMT2ACYP1A2CYP2D6KCNN4 | |
| Trifluoromethanesulfonic Acid SCHEMBL29188798 | 0.78 | CA1 (0.47) | MAPTKMT2ACYP1A2CYP2D6KCNN4 | |
| SCHEMBL29619 | 0.77 | MAPT (0.45) | MAPTKMT2ACYP1A2CYP2D6KCNN4 | |
| SCHEMBL4812417 | 0.77 | KCNN4 (0.46) | MAPTKMT2ACYP1A2CYP2D6KCNN4 | |
| SCHEMBL10940867 | 0.77 | KCNN4 (0.46) | MAPTKMT2ACYP1A2CYP2D6KCNN4 | |
| SCHEMBL31390769 | 0.77 | KCNN4 (0.46) | MAPTKMT2ACYP1A2CYP2D6KCNN4 | |
| Ammonia Solution, Strong SCHEMBL340602 | 0.76 | MAPT (0.43) | MAPTKMT2ACYP2D6KCNN4CA1 |
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-103601654-B | A kind of preparation method of taurine substitute | HUANGGANG FUCHI PHARMACEUTICAL CO., LTD. (CN) | 2015-12-09 | — | — | CN | disclosed |