Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL4120953 | 0.87 | MAPT (0.34) | MAPTCNR2ALDH1A1NPSR1 | |
| SCHEMBL3692824 | 0.84 | SLC16A3 (0.36) | MAPT | |
| SCHEMBL3812505 | 0.82 | CNR2 (0.33) | CNR2 | |
| SCHEMBL3700341 | 0.82 | HTR2C (0.44) | MAPTCNR2 | |
| SCHEMBL3700342 | 0.79 | RIPK1 (0.32) | MAPTCNR2TP53ALDH1A1NPSR1 | |
| SCHEMBL4120959 | 0.79 | MAPT (0.34) | MAPTCNR2TP53ALDH1A1NPSR1 | |
| SCHEMBL3690717 | 0.78 | ALDH1A1 (0.33) | MAPTCNR2ALDH1A1NPSR1 | |
| SCHEMBL3693917 | 0.77 | RIPK1 (0.32) | MAPTALDH1A1NPSR1 | |
| SCHEMBL3706263 | 0.76 | CNR2 (0.36) | CNR2NPSR1 | |
| SCHEMBL3703723 | 0.76 | KCNQ3 (0.30) | — |
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 |