Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.54 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.53 |
| ▸ | GPR183 | P32249 | 1/20 | 0.52 |
| ▸ | LSS | P48449 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 2/20 | 0.49 |
| ▸ | DRD4 | P21917 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL30065590 | 0.91 | GPR183 (0.55) | GPR183LSSTP53POLBPTGS2 | |
| SCHEMBL30064678 | 0.85 | TP53 (0.59) | GPR183LSSTP53POLBDRD4 | |
| SCHEMBL30065423 | 0.82 | LMNA (0.60) | KDM4EALDH1A1SMN1; SMN2POLBHTT | |
| SCHEMBL5060651 | 0.80 | CCR1 (0.56) | KDM4EALDH1A1SMN1; SMN2POLBHTT | |
| SCHEMBL14632611 | 0.78 | KDM4E (0.67) | KDM4EALDH1A1SMN1; SMN2NLRP3GPR183 | |
| SCHEMBL30064696 | 0.76 | KDM4E (0.70) | KDM4EALDH1A1SMN1; SMN2HTT | |
| SCHEMBL16598942 | 0.74 | AKR1C3 (0.69) | KDM4EGPR183POLB | |
| SCHEMBL3245334 | 0.74 | LMNA (0.60) | KDM4EALDH1A1SMN1; SMN2POLBHTT | |
| SCHEMBL28886761 | 0.74 | GPR183 (0.53) | KDM4EALDH1A1SMN1; SMN2NLRP3GPR183 | |
| SCHEMBL2931705 | 0.74 | AKR1C3 (0.65) | KDM4EALDH1A1GPR183LSSTP53 |
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 |