Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.52 |
| ▸ | BCHE | P06276 | 1/20 | 0.52 |
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6803332 | 0.85 | ALDH1A1 (0.55) | ALDH1A1BCHEACHEHTTEGFR | |
| SCHEMBL6954554 | 0.85 | ALDH1A1 (0.55) | ALDH1A1BCHEACHEHTTEGFR | |
| SCHEMBL6963150 | 0.84 | CHRM2 (0.47) | BCHEACHELMNA | |
| SCHEMBL8710128 | 0.82 | ALDH1A1 (0.51) | ALDH1A1BCHEACHEHTTEGFR | |
| SCHEMBL31555979 | 0.79 | GAA (0.48) | ALDH1A1HTTSMN1; SMN2MAPTKMT2A | |
| SCHEMBL8780852 | 0.77 | FKBP1A (0.53) | ALDH1A1BCHEACHEHTTEGFR | |
| SCHEMBL20595268 | 0.76 | ALDH1A1 (0.47) | ALDH1A1HTTSMN1; SMN2KMT2AHPGD | |
| SCHEMBL20595296 | 0.76 | ALDH1A1 (0.47) | ALDH1A1HTTSMN1; SMN2KMT2AHPGD | |
| SCHEMBL2333789 | 0.76 | ALDH1A1 (0.51) | ALDH1A1BCHEACHEHTTEGFR | |
| SCHEMBL11713022 | 0.76 | TRPM8 (0.36) | ALDH1A1HTTKMT2AHPGDTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0729465-B1 | PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS | PARKE DAVIS & CO (US) | 2003-01-22 | — | — | EP | disclosed |
| US-6005103-A | TREATMENT OF BACTERIAL AND VIRAL INFECTIONS AND DISEASES, INCLUDING AIDS | WARNER-LAMBERT COMPANY (US) | 1999-12-21 | — | — | US | disclosed |