Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 4/20 | 0.35 |
| ▸ | CA2 | P00918 | 4/20 | 0.35 |
| ▸ | CA9 | Q16790 | 4/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17563604 | 0.95 | HTT (0.42) | CYP1A2CYP2C19HTTLMNACA1 | |
| SCHEMBL18466949 | 0.91 | CYP1A2 (0.44) | CYP1A2CYP2C19KMT2AHTTLMNA | |
| SCHEMBL18680200 | 0.87 | CYP1A2 (0.43) | CYP1A2CYP2C19KMT2AHTTLMNA | |
| SCHEMBL18680425 | 0.87 | HTT (0.37) | HTTLMNACA1CA2CA9 | |
| SCHEMBL18679943 | 0.87 | HSP90AA1 (0.46) | KMT2AHTTLMNAMEN1CA1 | |
| SCHEMBL8075579 | 0.85 | KMT2A (0.48) | KMT2AHTTMAPT | |
| SCHEMBL17826471 | 0.85 | HTT (0.46) | CYP1A2CYP2C19KMT2AHTTLMNA | |
| SCHEMBL17576150 | 0.85 | HSP90AA1 (0.42) | CYP1A2CYP2C19HTTLMNAHSP90AA1 | |
| SCHEMBL18466906 | 0.85 | HTT (0.38) | CYP1A2CYP2C19HTTLMNACA1 | |
| SCHEMBL9102166 | 0.83 | CYP1A2 (0.53) | CYP1A2CYP2C19KMT2ALMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20170088671-A1 | SYNTHETIC POLYMERS AND METHODS OF MAKING AND USING THE SAME | BATTELLE MEMORIAL INSTITUTE (US) | 2017-03-30 | — | — | US | disclosed |