Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RELA | Q04206 | 4/20 | 0.44 |
| ▸ | CA2 | P00918 | 5/20 | 0.38 |
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 6/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 6/20 | 0.36 |
| ▸ | CA7 | P43166 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 4/20 | 0.33 |
| ▸ | CA9 | Q16790 | 4/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.33 |
| ▸ | CA4 | P22748 | 3/20 | 0.33 |
| ▸ | CA5A | P35218 | 3/20 | 0.33 |
| ▸ | CA3 | P07451 | 2/20 | 0.33 |
| ▸ | ADH1B | P00325 | 1/20 | 0.32 |
| ▸ | ADH1C | P00326 | 1/20 | 0.32 |
| ▸ | ADH1A | P07327 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27842133 | 0.92 | RELA (0.51) | RELACA2CA1TSHRALDH1A1 | |
| SCHEMBL28394782 | 0.81 | CA12 (0.39) | RELACA2CA1ALDH1A1CA12 | |
| SCHEMBL28769326 | 0.77 | CA2 (0.45) | RELACA2TSHRALDH1A1MEN1 | |
| Taurine SCHEMBL11570749 | 0.76 | CYP2C19 (0.52) | RELACA2CA1TSHRALDH1A1 | |
| SCHEMBL27823110 | 0.76 | S1PR2 (0.46) | RELACA2CA1TSHRALDH1A1 | |
| SCHEMBL27481942 | 0.76 | CA2 (0.44) | RELACA2CA1TSHRALDH1A1 | |
| SCHEMBL971408 | 0.76 | ALDH1A1 (0.52) | RELACA2CA1TSHRALDH1A1 | |
| SCHEMBL28271385 | 0.75 | LMNA (0.32) | CYP2C19 | |
| SCHEMBL27495687 | 0.73 | LMNA (0.31) | CYP2C19 | |
| SCHEMBL714443 | 0.73 | LMNA (0.45) | TSHRALDH1A1THPOCYP2C19PMP22 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0002675-A1 | Preparation of salt-free N-acyl taurines | GAF CORPORATION (US) | 1979-07-11 | — | — | EP | disclosed |