Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SNCA | P37840 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | GAA | P10253 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13314759 | 0.79 | MCL1 (0.54) | ALDH1A1MAPTNPC1RAB9ACYP3A4 | |
| SCHEMBL3579872 | 0.76 | ALDH1A1 (0.47) | ALDH1A1KDM4EMAPTGAANPC1 | |
| SCHEMBL20086026 | 0.75 | IRAK4 (0.48) | MAPTGAANPC1RAB9ANPSR1 | |
| SCHEMBL13314750 | 0.75 | NPC1 (0.49) | ALDH1A1MAPTGAANPC1RAB9A | |
| SCHEMBL13314755 | 0.73 | JAK2 (0.44) | MAPTNPC1RAB9APOLBLMNA | |
| Formic Acid SCHEMBL29911871 | 0.72 | IRAK4 (0.46) | MAPTGAANPC1RAB9ANPSR1 | |
| SCHEMBL23719268 | 0.71 | ADORA3 (0.51) | MAPTNPC1RAB9ALMNAKMT2A | |
| SCHEMBL18170033 | 0.71 | CHEK1 (0.55) | NPC1RAB9ATLR7 | |
| SCHEMBL29752180 | 0.71 | CHEK1 (0.55) | NPC1RAB9ATLR7 | |
| SCHEMBL20415626 | 0.69 | TLR7 (0.36) | ALDH1A1KDM4EMAPTGAANPC1 |
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-2020150545-A1 | PYRAZOLE DERIVATIVES AS MODULATORS OF THE WNT/B-CATENIN SIGNALING PATHWAY | SAMUMED, LLC (US) | 2020-07-23 | — | — | WO | disclosed |