Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 2/20 | 0.33 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | GLS | O94925 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.32 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3654372 | 0.89 | HTR2C (0.34) | HTR2CSLC6A4GLSPDK2CACNA1G | |
| SCHEMBL3652077 | 0.88 | SOS1 (0.36) | HTR2CSLC6A4GLSPDK2CACNA1G | |
| SCHEMBL4131192 | 0.87 | CTSD (0.34) | CTSDBACE1BACE2 | |
| SCHEMBL3654413 | 0.87 | HTR2C (0.33) | HTR2CSLC6A4GLSPDK2CACNA1G | |
| SCHEMBL3654926 | 0.86 | HTR2C (0.34) | HTR2CSLC6A4GLSPDK2CACNA1G | |
| SCHEMBL3652574 | 0.86 | HTR2C (0.35) | HTR2CSLC6A4GLSPDK2CACNA1G | |
| SCHEMBL3653613 | 0.85 | CLK1 (0.34) | HTR2CSLC6A4GLSPDK2 | |
| SCHEMBL3700377 | 0.85 | PDK2 (0.34) | HTR2CSLC6A4GLSPDK2CACNA1G | |
| SCHEMBL3654603 | 0.84 | CACNA1G (0.33) | HTR2CSLC6A4GLSPDK2CACNA1G | |
| SCHEMBL3707060 | 0.83 | HTR2C (0.34) | HTR2CSLC6A4GLSPDK2CACNA1G |
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 |