Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.32 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.31 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.31 |
| ▸ | GLS | O94925 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | FFAR4 | Q5NUL3 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3703108 | 0.94 | PDK2 (0.31) | PDK2AGTR2GLSSOS1 | |
| SCHEMBL4125938 | 0.88 | FFAR4 (0.34) | FFAR4 | |
| SCHEMBL3649951 | 0.86 | PDK2 (0.35) | PDK2CACNA1GCACNA1BCACNA1CGLS | |
| SCHEMBL3654948 | 0.86 | F2 (0.35) | PDK2AGTR2GLSHTR2CSLC6A4 | |
| SCHEMBL3804721 | 0.84 | ABCC9 (0.33) | PDK2CACNA1GCACNA1BCACNA1CGLS | |
| SCHEMBL3652358 | 0.84 | GLS (0.32) | PDK2GLSHTR2CSLC6A4SOS1 | |
| SCHEMBL4530415 | 0.84 | PDK2 (0.32) | PDK2SSTR4GLSHTR2CSLC6A4 | |
| SCHEMBL3651630 | 0.83 | HTR2C (0.32) | PDK2AGTR2SSTR4GLSHTR2C | |
| SCHEMBL3690491 | 0.83 | FFAR4 (0.32) | FFAR4 | |
| SCHEMBL3803075 | 0.82 | ALDH1A1 (0.33) | PDK2AGTR2HTR2CSLC6A4SOS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2190822-A2 | 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2010-06-02 | — | — | EP | disclosed |
| WO-2009041705-A9 | 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS | TAKEDA PHARMACEUTICAL (JP) | 2009-08-13 | — | — | WO | disclosed |
| WO-2009041705-A2 | 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-04-02 | — | — | WO | disclosed |