Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL28111228 | 0.79 | PKM (0.43) | PKMJMJD6NAMPTKMT2AHCAR2 | |
| SCHEMBL27439148 | 0.76 | — | — | |
| Methylamine SCHEMBL27628958 | 0.73 | HCAR2 (0.39) | PKMALDH1A1KDM4EHSD17B10HCAR2 | |
| SCHEMBL7102277 | 0.72 | ALDH1A1 (0.40) | ALDH1A1KDM4EKMT2AMEN1SOAT1 | |
| SCHEMBL15716188 | 0.72 | — | — | |
| SCHEMBL18886843 | 0.71 | ALDH1A1 (0.43) | ALDH1A1KDM4EKMT2AMEN1SOAT1 | |
| SCHEMBL2052901 | 0.71 | JMJD6 (0.52) | PKMJMJD6NAMPTALDH1A1KDM4E | |
| SCHEMBL3677892 | 0.71 | ALDH1A1 (0.39) | ALDH1A1KDM4EKMT2AMEN1SOAT1 | |
| SCHEMBL4039329 | 0.71 | ATAD2 (0.49) | ALDH1A1KDM4EKMT2AMEN1HSD17B10 | |
| SCHEMBL3917643 | 0.70 | ALDH1A1 (0.41) | PKMALDH1A1KDM4EKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998027091-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS AS PESTICIDES | MERCK PATENT GMBH (DE) | 1998-06-25 | — | — | WO | disclosed |