Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 8/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 4/20 | 0.34 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.33 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.33 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.33 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | FPR1 | P21462 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PTGER2 | P43116 | 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 | |
|---|---|---|---|---|
| SCHEMBL3700851 | 0.92 | HTR2C (0.39) | HTR2CSLC6A4HTR2ARORC | |
| SCHEMBL3693157 | 0.92 | HTR2C (0.43) | HTR2CSLC6A4HTR2ANAMPTABCC9 | |
| SCHEMBL3697102 | 0.89 | HTR2C (0.41) | HTR2CSLC6A4HTR2ANAMPT | |
| SCHEMBL4566347 | 0.89 | HTR2C (0.39) | HTR2CSLC6A4HTR2AABCC9ABCC8 | |
| SCHEMBL4131429 | 0.88 | KEAP1 (0.36) | NAMPTALDH1A1KEAP1NFE2L2LMNA | |
| SCHEMBL3808572 | 0.87 | HTR2C (0.41) | HTR2CSLC6A4HTR2ANAMPTABCC9 | |
| SCHEMBL3699812 | 0.85 | HTR2C (0.38) | HTR2CSLC6A4HTR2AABCC9ABCC8 | |
| SCHEMBL3695801 | 0.85 | HTR2C (0.38) | HTR2CSLC6A4HTR2ANAMPTABCC9 | |
| SCHEMBL3701316 | 0.85 | HTR2C (0.38) | HTR2CSLC6A4HTR2ANAMPTABCC9 | |
| SCHEMBL3705296 | 0.83 | NAMPT (0.34) | NAMPTABCC9ABCC8KCNJ11KCNJ8 |
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 |