Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.36 |
| ▸ | TRAP1 | Q12931 | 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 | |
|---|---|---|---|---|
| SCHEMBL28116675 | 0.88 | KMT2A (0.45) | KMT2APKMALDH1A1POLBMEN1 | |
| SCHEMBL28116296 | 0.88 | RIPK1 (0.60) | RIPK1CYP1A2CYP2C19KMT2APKM | |
| SCHEMBL17316603 | 0.80 | HDAC1 (0.49) | KMT2APKMALDH1A1POLBMAPT | |
| SCHEMBL28116788 | 0.80 | LMNA (0.55) | RIPK1CYP1A2CYP2C19KMT2APKM | |
| SCHEMBL1865930 | 0.80 | LMNA (0.47) | CYP1A2CYP2C19KMT2APKMALDH1A1 | |
| SCHEMBL28116300 | 0.80 | HDAC1 (0.47) | RIPK1CYP1A2CYP2C19KMT2APKM | |
| SCHEMBL17316704 | 0.78 | LMNA (0.44) | KMT2APKMALDH1A1POLBMEN1 | |
| SCHEMBL17316539 | 0.77 | LMNA (0.44) | CYP1A2CYP2C19KMT2APKMALDH1A1 | |
| SCHEMBL765196 | 0.77 | PTGER1 (0.68) | PTGER1 | |
| SCHEMBL28116367 | 0.77 | RECQL (0.52) | KMT2APKMALDH1A1LMNA |
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-106146400-A | Benzyl-1H-pyrazoles, benzyl-1H-azole derivatives and its production and use | 四川大学 | 2016-11-23 | — | — | CN | disclosed |