Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14506136 | 0.86 | ADORA2A (0.42) | GSTP1ADORA2AADORA1CA1CA2 | |
| SCHEMBL15205251 | 0.83 | PPARG (0.47) | PTGS2CA1CA2CA9PPARG | |
| SCHEMBL14506126 | 0.83 | CA2 (0.54) | GSTP1ADORA2AADORA1PTGS2CA1 | |
| SCHEMBL10041706 | 0.83 | CA2 (0.54) | GSTP1ADORA2AADORA1PTGS2CA1 | |
| SCHEMBL11977690 | 0.82 | CA2 (0.53) | GSTP1ADORA2AADORA1CA1CA2 | |
| SCHEMBL4684800 | 0.81 | PTPN1 (0.47) | ADORA2AADORA1HDAC2CA1CA2 | |
| SCHEMBL7795722 | 0.81 | CYP1A2 (0.39) | GSTP1ADORA2AADORA1HDAC4HDAC2 | |
| SCHEMBL11978647 | 0.81 | CA2 (0.45) | ADORA2AADORA1CA1CA2CA9 | |
| SCHEMBL13416088 | 0.81 | CA1 (0.45) | ADORA2AADORA1HDAC4HDAC2HDAC8 | |
| SCHEMBL25040047 | 0.80 | CA2 (0.47) | ADORA2AADORA1CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| JP-7247234-A | — | — | None | — | — | JP | disclosed |
| JP-H07247234-A | BIARYL COMPOUND AND ITS PRODUCTION | SUMITOMO CHEM CO LTD | 1995-09-26 | — | — | JP | disclosed |