Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 2/20 | 0.46 |
| ▸ | PPARA | Q07869 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.41 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.41 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.41 |
| ▸ | ALB | P02768 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | RARB | P10826 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18698817 | 0.85 | ACACB (0.50) | ACACBPPARGPPARAHPGDFFAR1 | |
| SCHEMBL12696346 | 0.85 | TBXAS1 (0.53) | ACACBPPARGPPARAHPGDFFAR1 | |
| SCHEMBL12794955 | 0.85 | ACACB (0.50) | ACACBPPARGPPARAHPGDFFAR1 | |
| SCHEMBL1716550 | 0.85 | TBXAS1 (0.53) | ACACBPPARGPPARAHPGDFFAR1 | |
| SCHEMBL14499001 | 0.85 | ACACB (0.50) | ACACBPPARGPPARAHPGDFFAR1 | |
| SCHEMBL10081972 | 0.85 | TBXAS1 (0.53) | ACACBPPARGPPARAHPGDFFAR1 | |
| SCHEMBL12118748 | 0.83 | EPHX1 (0.50) | ACACBPPARGPPARAHPGDGAA | |
| SCHEMBL22593510 | 0.83 | EPHX1 (0.50) | ACACBPPARGPPARAHPGDGAA | |
| SCHEMBL2486083 | 0.83 | ACACB (0.45) | ACACBPPARGPPARAHPGDFFAR1 | |
| SCHEMBL7753247 | 0.83 | TAAR1 (0.57) | GAAESR1 |
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-4079059-A | ANTIMICROBIAL, ALGAE INHIBITORS | MERCK & CO., INC. (US) | 1978-03-14 | — | — | US | disclosed |