Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | FBP1 | P09467 | 6/20 | 0.38 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.37 |
| ▸ | PPARD | Q03181 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10663114 | 0.87 | PPARA (0.44) | PPARACYP1A2CYP3A4GPBAR1PTGS1 | |
| SCHEMBL10659368 | 0.83 | PPARA (0.40) | PPARAGPBAR1PTGS1PPARGPPARD | |
| SCHEMBL10662256 | 0.82 | ALDH1A1 (0.44) | TSHRGPBAR1PTGS1HPGDMAPK1 | |
| SCHEMBL10663477 | 0.82 | PPARA (0.40) | PPARAGPBAR1PTGS1PPARGPPARD | |
| SCHEMBL10660008 | 0.82 | GPBAR1 (0.37) | TSHRGPBAR1PTGS1HPGDMAPK1 | |
| SCHEMBL10659373 | 0.81 | KDM4E (0.42) | PPARATSHRGPBAR1PTGS1PPARG | |
| SCHEMBL10662964 | 0.79 | TSHR (0.43) | PPARATSHRGPBAR1PTGS1PPARG | |
| SCHEMBL10658060 | 0.77 | ALDH1A1 (0.42) | PPARATSHRGPBAR1PTGS1PPARG | |
| SCHEMBL11016219 | 0.77 | GPBAR1 (0.38) | TSHRGPBAR1PTGS1HPGDMAPK1 | |
| SCHEMBL10661841 | 0.76 | MAPT (0.41) | PPARAGPBAR1PTGS1PPARGPPARD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4673746-A | DIURETICS, HYPOTENSIVES | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1987-06-16 | — | — | US | claimed |
| US-4728662-A | DIURETICS, URICOSURICS, HYPOTENSIVES | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1988-03-01 | — | — | US | disclosed |
| US-4673746-A | DIURETICS, HYPOTENSIVES | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1987-06-16 | — | — | US | disclosed |