Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 5/20 | 0.33 |
| ▸ | VKORC1 | Q9BQB6 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9037798 | 0.88 | HTR2B (0.34) | CYP2C9VKORC1LMNASMN1; SMN2HTR2B | |
| SCHEMBL6174697 | 0.87 | HTR2B (0.43) | CYP2C9VKORC1KDM4ESMN1; SMN2HTR2B | |
| SCHEMBL6176220 | 0.86 | VKORC1 (0.37) | CYP2C9VKORC1KDM4EALDH1A1LMNA | |
| SCHEMBL6173304 | 0.85 | HTR2B (0.43) | SMN1; SMN2HTR2BHTR3A | |
| SCHEMBL6174391 | 0.85 | HTR2B (0.46) | LMNASMN1; SMN2HTR2BHTR3ADAO | |
| SCHEMBL27333913 | 0.85 | VKORC1 (0.36) | CYP2C9VKORC1KDM4EALDH1A1LMNA | |
| SCHEMBL9195012 | 0.84 | CYP2C9 (0.33) | CYP2C9VKORC1KDM4EALDH1A1LMNA | |
| SCHEMBL9198737 | 0.84 | CYP2C9 (0.34) | CYP2C9VKORC1LMNASMN1; SMN2 | |
| SCHEMBL6178504 | 0.83 | HPGD (0.33) | CYP2C9VKORC1KDM4EALDH1A1LMNA | |
| SCHEMBL6174524 | 0.82 | CYP2C9 (0.36) | CYP2C9VKORC1 |
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-0668860-A1 | PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES | PHARMACIA & UPJOHN COMPANY (US) | 1995-08-30 | — | — | EP | claimed |
| EP-0668860-A1 | PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES | PHARMACIA & UPJOHN COMPANY (US) | 1995-08-30 | — | — | EP | disclosed |