Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.50 |
| ▸ | RELA | Q04206 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.47 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29016622 | 1.00 | SRD5A2 (0.52) | SRD5A2KDM4ENFKB1NFKB2RELA | |
| SCHEMBL30370174 | 0.90 | HDAC6 (0.58) | SRD5A2SMN1; SMN2TRPV1NPC1RAB9A | |
| SCHEMBL29016567 | 0.90 | HDAC6 (0.58) | SRD5A2SMN1; SMN2TRPV1NPC1RAB9A | |
| SCHEMBL30370117 | 0.87 | GPR52 (0.54) | KDM4ENFKB1NFKB2RELALMNA | |
| SCHEMBL29016605 | 0.87 | GPR52 (0.54) | KDM4ENFKB1NFKB2RELALMNA | |
| SCHEMBL29016645 | 0.85 | DYRK1A (0.48) | KDM4ENFKB1NFKB2RELALMNA | |
| SCHEMBL30370368 | 0.85 | DYRK1A (0.48) | KDM4ENFKB1NFKB2RELALMNA | |
| SCHEMBL8357909 | 0.82 | MAOB (0.50) | KDM4ELMNATRPV1MAPTALDH1A1 | |
| SCHEMBL3919868 | 0.82 | KDM4E (0.70) | SRD5A2KDM4ENFKB1NFKB2RELA | |
| SCHEMBL30370207 | 0.80 | EPHX2 (0.44) | TRPV1MAPTNPC1ALDH1A1RAB9A |
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-108689942-B | Nitrogen-containing bicyclic compound, and preparation method and application thereof | 广东东阳光药业有限公司 | 2023-06-09 | — | — | CN | disclosed |