Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 6/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.37 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12136107 | 0.85 | MAPT (0.41) | HTR6KDM4EPTGS2MAPTALDH1A1 | |
| Fumaric Acid SCHEMBL1357682 | 0.80 | ALDH1A1 (0.38) | HTR6KDM4EMAPTALDH1A1 | |
| Fumaric Acid SCHEMBL1357683 | 0.80 | ALDH1A1 (0.38) | HTR6KDM4EMAPTALDH1A1 | |
| SCHEMBL1357284 | 0.79 | NAPRT (0.41) | HTR6KDM4EPTGS2NAPRTMAPT | |
| SCHEMBL13999993 | 0.74 | HTT (0.43) | KDM4EMAPTCYP2C19ALDH1A1 | |
| Methylamine SCHEMBL28637857 | 0.72 | CYP2A6 (0.40) | HTR6KDM4EPTGS2NAPRTCA12 | |
| SCHEMBL29419685 | 0.69 | HTR6 (0.40) | HTR6KDM4ENAPRTMAPT | |
| SCHEMBL22769478 | 0.68 | KDM4E (0.39) | HTR6KDM4EPTGS2NAPRTCA12 | |
| SCHEMBL1357648 | 0.68 | NR1H2 (0.49) | HTR6KDM4EMAPTALDH1A1 | |
| SCHEMBL1156179 | 0.68 | HTR6 (0.42) | HTR6MAPTCYP2C19ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2005957-B1 | ACID SECRETION INHIBITOR | TAKEDA PHARMACEUTICAL (JP) | 2012-05-30 | — | — | EP | disclosed |
| EP-2005957-A1 | ACID SECRETION INHIBITOR | Takeda Pharmaceutical Company Limited (JP) | 2008-12-24 | — | — | EP | disclosed |