Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.32 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TOP2A | P11388 | 1/20 | 0.31 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.30 |
| ▸ | PIM1 | P11309 | 1/20 | 0.30 |
| ▸ | CDK9 | P50750 | 1/20 | 0.30 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.30 |
| ▸ | TNF | P01375 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28892698 | 1.00 | KDM4E (0.37) | KDM4EHTTPOLBRAD52MAOA | |
| SCHEMBL30829727 | 0.83 | KDM4E (0.40) | KDM4EHTTPOLBRAD52MAOA | |
| SCHEMBL28892449 | 0.83 | KDM4E (0.40) | KDM4EHTTPOLBRAD52MAOA | |
| SCHEMBL28892447 | 0.79 | CLK1 (0.38) | KDM4EHTTPOLBRAD52LOXL2 | |
| SCHEMBL30002819 | 0.79 | CLK1 (0.38) | KDM4EHTTPOLBRAD52LOXL2 | |
| SCHEMBL30829779 | 0.77 | KDM4E (0.40) | KDM4EHTTPOLBRAD52MAOA | |
| SCHEMBL28892549 | 0.77 | KDM4E (0.40) | KDM4EHTTPOLBRAD52MAOA | |
| SCHEMBL28892536 | 0.72 | LOXL2 (0.35) | KDM4EALDH1A1LMNAHPGDLOXL2 | |
| SCHEMBL30001957 | 0.72 | LOXL2 (0.35) | KDM4EALDH1A1LMNAHPGDLOXL2 | |
| SCHEMBL19948591 | 0.69 | TOP2A (0.41) | KDM4EHTTPOLBRAD52MAOA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115232144-B | Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof | 长春金赛药业有限责任公司 | 2024-04-02 | — | — | CN | disclosed |
| CN-115232144-A | Nitrogen-containing fused ring derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2022-10-25 | — | — | CN | disclosed |