Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.35 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.35 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.35 |
| ▸ | NAAA | Q02083 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3427035 | 0.94 | CYP2C19 (0.42) | EPHX1CYP2C19MAPTPRSS1TPSAB1 | |
| SCHEMBL2906878 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL2457476 | 0.73 | NPSR1 (0.39) | MAPTLMNANPSR1 | |
| SCHEMBL16086282 | 0.71 | CYP2C19 (0.48) | EPHX1CYP2C19MAPTNAAACA12 | |
| SCHEMBL4433368 | 0.69 | MAPT (0.50) | MAPTLMNANPSR1 | |
| SCHEMBL28778803 | 0.69 | CYP2C19 (0.52) | EPHX1CYP2C19MAPTNAAACA12 | |
| SCHEMBL9485096 | 0.69 | CYP2C19 (0.52) | EPHX1CYP2C19MAPTNAAACA12 | |
| SCHEMBL2706509 | 0.69 | CYP2C19 (0.43) | EPHX1CYP2C19PRSS1TPSAB1TPSD1 | |
| SCHEMBL5493739 | 0.69 | CYP2C19 (0.52) | EPHX1CYP2C19MAPTNAAACA12 | |
| SCHEMBL16086274 | 0.69 | CYP2C19 (0.47) | EPHX1CYP2C19MAPTNAAACA12 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2401257-A1 | ENZYME INHIBITORS | Chroma Therapeutics Ltd. (GB) | 2012-01-04 | — | — | EP | disclosed |
| WO-2010097586-A1 | ENZYME INHIBITORS | CHROMA THERAPEUTICS LTD. (GB) | 2010-09-02 | — | — | WO | disclosed |