Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.45 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.45 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.45 |
| ▸ | ELAVL1 | Q15717 | 1/20 | 0.44 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 2/20 | 0.39 |
| ▸ | MMP8 | P22894 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1156549 | 0.88 | KMT2A (0.52) | ALDH3A1ELAVL1PKMLMNASMN1; SMN2 | |
| SCHEMBL1156191 | 0.80 | KDM4E (0.49) | ALDH3A1ELAVL1PKMLMNASMN1; SMN2 | |
| SCHEMBL1156669 | 0.78 | KMT2A (0.61) | ELAVL1LMNASMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL1580773 | 0.77 | HTR6 (0.46) | ALDH3A1ELAVL1PKML3MBTL1KDM4E | |
| SCHEMBL1156559 | 0.76 | TSHR (0.52) | AGTR1LMNASMN1; SMN2L3MBTL1KDM4E | |
| Hydrochloric Acid SCHEMBL1157184 | 0.76 | HTR6 (0.45) | ALDH3A1ELAVL1PKML3MBTL1KDM4E | |
| SCHEMBL947625 | 0.75 | AKR1C3 (0.78) | AKR1C3AKR1C1ALDH3A1LMNASMN1; SMN2 | |
| SCHEMBL1156781 | 0.72 | ALDH1A1 (0.47) | PKMLMNASMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL4638916 | 0.72 | NOTUM (0.42) | LMNAKDM4EKMT2A | |
| SCHEMBL9400093 | 0.71 | AKR1C3 (0.46) | AKR1C3AKR1C1PKMLMNASMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1803709-B1 | PROTON PUMP INHIBITORS | TAKEDA PHARMACEUTICAL (JP) | 2013-01-02 | — | — | EP | disclosed |