Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 3/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.37 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 2/20 | 0.35 |
| ▸ | GLS | O94925 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | GBA1 | P04062 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.32 |
| ▸ | AGTR2 | P50052 | 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 | |
|---|---|---|---|---|
| SCHEMBL3648432 | 0.92 | GPBAR1 (0.39) | HTR2CSLC6A4GPBAR1F2RXFP1 | |
| SCHEMBL4138201 | 0.88 | GPBAR1 (0.37) | GPBAR1RXFP1POLBNAMPT | |
| SCHEMBL3652834 | 0.87 | HTR2C (0.34) | HTR2CSLC6A4F2GLSPDK2 | |
| Hydrochloric Acid SCHEMBL3654116 | 0.86 | HTR6 (0.35) | HTR2CGPBAR1F2GLSRXFP1 | |
| Hydrochloric Acid SCHEMBL3645132 | 0.85 | GLS (0.34) | HTR2CSLC6A4F2GLSPDK2 | |
| SCHEMBL3654948 | 0.84 | F2 (0.35) | HTR2CSLC6A4GPBAR1F2GLS | |
| Hydrochloric Acid SCHEMBL3650185 | 0.83 | F2 (0.33) | HTR2CSLC6A4F2GLSNAMPT | |
| SCHEMBL3651630 | 0.83 | HTR2C (0.32) | HTR2CSLC6A4GLSPDK2SOS1 | |
| SCHEMBL3803075 | 0.82 | ALDH1A1 (0.33) | HTR2CSLC6A4GPBAR1F2PDK2 | |
| SCHEMBL3650557 | 0.82 | GPBAR1 (0.35) | GPBAR1RXFP1POLBPTGDR2NAMPT |
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 |