Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23142318 | 0.82 | HSD11B1 (0.39) | KDM4EL3MBTL1CYP17A1CYP1A2ALDH1A1 | |
| SCHEMBL23142295 | 0.79 | KDM4E (0.35) | KDM4EL3MBTL1CYP17A1CYP1A2MEN1 | |
| SCHEMBL423520 | 0.78 | KDM4E (0.35) | KDM4EL3MBTL1CYP17A1CYP1A2MEN1 | |
| SCHEMBL23142321 | 0.78 | KDM4E (0.35) | KDM4EL3MBTL1CYP17A1CYP1A2MEN1 | |
| SCHEMBL31036882 | 0.78 | KDM4E (0.35) | KDM4EL3MBTL1CYP17A1CYP1A2MEN1 | |
| SCHEMBL27877177 | 0.78 | TRPV1 (0.35) | KDM4EL3MBTL1CYP17A1CYP1A2TRPV1 | |
| SCHEMBL19086951 | 0.75 | MALT1 (0.38) | ALDH1A1TRPA1 | |
| SCHEMBL27860571 | 0.73 | KDM4E (0.40) | KDM4ETRPV1HSD11B1KCNH2TRPA1 | |
| SCHEMBL12859503 | 0.73 | TRPV1 (0.39) | KDM4EL3MBTL1CYP17A1CYP1A2MEN1 | |
| SCHEMBL426107 | 0.72 | SLC16A3 (0.39) | KDM4EL3MBTL1ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-102753531-A | Method for producing 1-alkyl-/1-aryl-5-pyrazole-carboxylic acid derivatives | BAYER CROPSCIENCE AG | 2012-10-24 | — | — | CN | disclosed |