Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | RAD52 | P43351 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 6/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9302640 | 0.88 | ALDH1A1 (0.46) | DRD3GAAKDM4EALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL9302455 | 0.87 | ALDH1A1 (0.45) | DRD3GAAKDM4EALDH1A1MEN1 | |
| SCHEMBL9302145 | 0.82 | CRBN (0.38) | DRD3GAARAD52KDM4EALDH1A1 | |
| SCHEMBL9301938 | 0.79 | DRD3 (0.43) | DRD3GAARAD52KDM4EALDH1A1 | |
| SCHEMBL9303411 | 0.79 | ALDH1A1 (0.41) | DRD3GAARAD52KDM4EALDH1A1 | |
| SCHEMBL6803657 | 0.75 | DRD3 (0.53) | DRD3GAARAD52KDM4EALDH1A1 | |
| SCHEMBL9302223 | 0.69 | KDM4E (0.41) | KDM4EALDH1A1HPGDLMNA | |
| SCHEMBL9301465 | 0.69 | ALDH1A1 (0.45) | GAAKDM4EALDH1A1HPGDLMNA | |
| SCHEMBL9302393 | 0.68 | KDM4E (0.38) | KDM4EALDH1A1HPGDLMNA | |
| SCHEMBL9302904 | 0.68 | ALDH1A1 (0.45) | GAAKDM4EALDH1A1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5283248-A | Bactericides, enzyme inhibitor of DNA-gyrase in bacteria | HOFFMANN-LA ROCHE INC. (US) | 1994-02-01 | — | — | US | disclosed |