Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 8/20 | 0.81 |
| ▸ | GSK3A | P49840 | 1/20 | 0.64 |
| ▸ | SRD5A1 | P18405 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30999951 | 0.89 | GSK3B (1.00) | GSK3BGSK3ASRD5A1ALDH1A1ALOX15 | |
| SCHEMBL30999966 | 0.84 | GSK3B (0.74) | GSK3BGSK3ASRD5A1MAPT | |
| SCHEMBL30999969 | 0.84 | GSK3B (0.74) | GSK3BGSK3ASRD5A1MAPT | |
| SCHEMBL30999936 | 0.81 | GSK3B (0.76) | GSK3BGSK3ASRD5A1TSHR | |
| SCHEMBL6586836 | 0.80 | GSK3B (1.00) | GSK3BGSK3AALDH1A1HPGDTSHR | |
| SCHEMBL6583043 | 0.78 | GSK3B (0.52) | GSK3BGSK3ASRD5A1ALDH1A1HPGD | |
| SCHEMBL5946290 | 0.78 | GSK3B (0.65) | GSK3BGSK3A | |
| SCHEMBL31000001 | 0.76 | GSK3B (0.83) | GSK3BGSK3ASRD5A1 | |
| SCHEMBL5324331 | 0.72 | GSK3B (0.46) | GSK3BGSK3AALDH1A1PTGS2LMNA | |
| SCHEMBL31000017 | 0.72 | GSK3B (0.46) | GSK3BGSK3AALDH1A1KMT2APTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024163852-A1 | HISTIDINE KINASE INHIBITORS AS ANTIBACTERIAL AGENTS | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2024-08-08 | — | — | WO | disclosed |