Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 8/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 4/20 | 0.32 |
| ▸ | CNR1 | P21554 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.30 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.30 |
| ▸ | GPR6 | P46095 | 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 | |
|---|---|---|---|---|
| SCHEMBL4200021 | 0.90 | HTR2C (0.36) | HTR2CSLC6A4HTR2AALDH1A1MEN1 | |
| SCHEMBL4130737 | 0.89 | ALDH1A1 (0.38) | HTR2CHTR2ASMN1; SMN2CNR2CNR1 | |
| SCHEMBL3706787 | 0.89 | CNR1 (0.32) | CNR2CNR1ALDH1A1THRBMEN1 | |
| SCHEMBL3700225 | 0.88 | HTR2C (0.39) | HTR2CSLC6A4HTR2AALDH1A1MEN1 | |
| SCHEMBL3698449 | 0.88 | NR2F2 (0.35) | HTR2CSLC6A4HTR2ACNR2CNR1 | |
| SCHEMBL3700978 | 0.87 | HTR2C (0.45) | HTR2CSLC6A4HTR2ACNR2ALDH1A1 | |
| SCHEMBL3703585 | 0.87 | HTR2C (0.41) | HTR2CSLC6A4HTR2AALDH1A1THRB | |
| SCHEMBL3697102 | 0.87 | HTR2C (0.41) | HTR2CSLC6A4HTR2AGPR6 | |
| SCHEMBL3698341 | 0.87 | HTR2C (0.38) | HTR2CSLC6A4HTR2ATHRBLMNA | |
| SCHEMBL3698587 | 0.85 | HTR2C (0.42) | HTR2CSLC6A4HTR2ASMN1; SMN2ALDH1A1 |
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 |