Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.36 |
| ▸ | HBB | P68871 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 6/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | LOX | P28300 | 4/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18331940 | 0.82 | MAP4K4 (0.42) | KDM4EMEN1KMT2AALDH1A1BRCA1 | |
| SCHEMBL16792742 | 0.81 | LOXL2 (0.42) | KDM4EMEN1KMT2AALDH1A1BRCA1 | |
| SCHEMBL18331939 | 0.81 | CYP1A2 (0.47) | KDM4EMEN1KMT2AALDH1A1BRCA1 | |
| SCHEMBL18331936 | 0.73 | KDM4E (0.49) | KDM4EMEN1KMT2AALDH1A1POLB | |
| SCHEMBL18330558 | 0.72 | GCK (0.41) | MEN1KMT2AMAPK8MAPK10 | |
| SCHEMBL31221536 | 0.72 | GCK (0.41) | MEN1KMT2AMAPK8MAPK10 | |
| SCHEMBL18332123 | 0.72 | KDM4E (0.36) | KDM4EMEN1KMT2APOLBMAPK8 | |
| SCHEMBL18331935 | 0.72 | SMN1; SMN2 (0.49) | MEN1KMT2AALDH1A1JAK2JAK1 | |
| Hydrochloric Acid SCHEMBL31221545 | 0.71 | GCK (0.40) | MEN1KMT2AMAPK8MAPK10 | |
| SCHEMBL20084126 | 0.70 | KEAP1 (0.42) | MEN1KMT2AALDH1A1CYP1A2CYP2C19 |
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-2016204261-A1 | AMINOPYRAZOLE DERIVATIVES | 中外製薬株式会社 | 2016-12-22 | — | — | WO | disclosed |