Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL943590 | 0.63 | BCHE (0.61) | BCHEPTGS2ALDH1A1KDM4ETSHR | |
| SCHEMBL23402694 | 0.62 | BCHE (0.74) | BCHEPTGS2GAAALDH1A1KDM4E | |
| SCHEMBL23398749 | 0.61 | BCHE (0.54) | BCHEPTGS2GAAALDH1A1KDM4E | |
| SCHEMBL23398382 | 0.60 | BCHE (0.56) | BCHEPTGS2GAAALDH1A1KDM4E | |
| SCHEMBL23401048 | 0.59 | BCHE (0.54) | BCHEPTGS2GAAALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL19744043 | 0.58 | APP (0.33) | — | |
| SCHEMBL945107 | 0.57 | BCHE (0.71) | BCHEPTGS2ALDH1A1KDM4ETSHR | |
| SCHEMBL521938 | 0.57 | CALM1 (0.41) | ALDH1A1HPGDKDM4E | |
| Hydrochloric Acid SCHEMBL8151422 | 0.57 | HTR2A (0.37) | — | |
| Ampyrone SCHEMBL11674586 | 0.56 | BCHE (1.00) | BCHEPTGS2GAAALDH1A1KDM4E |
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-2009098257-A1 | COMPOSITION FOR DYEING KERATIN FIBRES COMPRISING AT LEAST ONE CATIONIC DIAMINO-N,N-DIHYDROPYRAZOLONE DERIVATIVE | L'OREAL (FR) | 2009-08-13 | — | — | WO | disclosed |