Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL30064678 | 0.85 | TP53 (0.59) | LMNAPOLB | |
| SCHEMBL30065423 | 0.85 | LMNA (0.60) | KDM4EALDH1A1LMNASMN1; SMN2POLB | |
| SCHEMBL30064781 | 0.84 | — | — | |
| SCHEMBL30064690 | 0.84 | SIGMAR1 (0.66) | MEN1KMT2AHIF1A | |
| SCHEMBL30064831 | 0.82 | ALDH1A1 (0.63) | KDM4ETSHRALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL7130439 | 0.81 | LMNA (0.72) | KDM4ETSHRALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL30064680 | 0.81 | FAAH (0.59) | TSHRALDH1A1LMNASMN1; SMN2CYP3A4 | |
| SCHEMBL30064696 | 0.81 | KDM4E (0.70) | KDM4ETSHRALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL30064675 | 0.80 | ALDH1A1 (0.62) | KDM4EALDH1A1LMNASMN1; SMN2POLB | |
| SCHEMBL8144850 | 0.80 | HRH3 (0.71) | KDM4ETSHRALDH1A1SMN1; SMN2POLB |
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-110615774-B | Benzyl piperazine compound with anti-inflammatory activity, preparation method and medical application | 安徽中医药大学 | 2022-11-11 | — | — | CN | disclosed |