Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | TYK2 | P29597 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 2/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 2/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7565415 | 0.79 | MAPK14 (0.65) | MAPK13MAPK12MAPK11MAPK14MAPT | |
| SCHEMBL7571478 | 0.75 | MAPK14 (0.67) | MAPK13MAPK12MAPK11MAPK14KMT2A | |
| SCHEMBL7090488 | 0.75 | JAK2 (0.53) | JAK2TYK2ALDH1A1KDM4ECHRM2 | |
| SCHEMBL8307733 | 0.74 | KMT2A (0.64) | JAK2TYK2ALDH1A1CHRM2CHRM3 | |
| SCHEMBL9038897 | 0.74 | GAA (0.46) | ALDH1A1KDM4EMAPK13MAPK12MAPK11 | |
| SCHEMBL5151745 | 0.73 | NPC1 (0.32) | NPC1RAB9A | |
| Bromide SCHEMBL7429002 | 0.71 | NPC1 (0.32) | NPC1RAB9A | |
| SCHEMBL7563806 | 0.71 | MAPK13 (0.68) | ALDH1A1LMNAHTTMAPK13MAPK12 | |
| SCHEMBL29088628 | 0.70 | MAPT (0.51) | JAK2TYK2ALDH1A1LMNACYP3A4 | |
| SCHEMBL7035012 | 0.70 | CYP3A4 (0.48) | JAK2TYK2ALDH1A1LMNACHRM2 |
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-2002083622-A2 | NOVEL AMINOPHENYL KETONE DERIVATIVES | LEO PHARMA A/S (DK) | 2002-10-24 | — | — | WO | disclosed |