Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.42 |
| ▸ | FLT3 | P36888 | 1/20 | 0.36 |
| ▸ | SLC16A3 | O15427 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SLC16A1 | P53985 | 3/20 | 0.35 |
| ▸ | HTR6 | P50406 | 2/20 | 0.35 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | APLNR | P35414 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3697401 | 0.99 | NFE2L2 (0.41) | NFE2L2FLT3SLC16A3SMN1; SMN2SLC16A1 | |
| Hydrochloric Acid SCHEMBL4131384 | 0.86 | HTR6 (0.36) | SMN1; SMN2HTR6MAPK11MAPK14HTR2A | |
| SCHEMBL4125307 | 0.83 | NFE2L2 (0.38) | NFE2L2SLC16A3SMN1; SMN2SLC16A1POLB | |
| SCHEMBL3698987 | 0.82 | SLC16A3 (0.40) | NFE2L2SLC16A3SLC16A1 | |
| Hydrochloric Acid SCHEMBL3706318 | 0.81 | SLC16A3 (0.40) | SLC16A3SLC16A1HTR6MAPK14HTR2A | |
| SCHEMBL3691770 | 0.79 | SLC16A3 (0.40) | NFE2L2SLC16A3SLC16A1RXRANR1H2 | |
| SCHEMBL3691768 | 0.79 | HTR2C (0.42) | NFE2L2SLC16A3SLC16A1HTR2CSLC6A4 | |
| SCHEMBL2836227 | 0.77 | SLC6A4 (0.37) | FLT3SLC16A3SLC16A1MAPK11MAPK14 | |
| Hydrochloric Acid SCHEMBL3704802 | 0.77 | MAPK14 (0.35) | SLC16A3SLC16A1HTR6MAPK11MAPK14 | |
| Fumaric Acid SCHEMBL4136237 | 0.77 | NAMPT (0.38) | SLC16A3SMN1; SMN2SLC16A1 |
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-2190822-B1 | 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS | TAKEDA PHARMACEUTICAL (JP) | 2014-12-31 | — | — | EP | disclosed |