Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA3 | P51812 | 8/20 | 0.45 |
| ▸ | VRK1 | Q99986 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.38 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8420067 | 0.81 | RPS6KA3 (0.46) | RPS6KA3VRK1HSD17B1HSD17B2 | |
| SCHEMBL6889137 | 0.78 | ESR1 (0.48) | ESR1ESR2ERN1HSD17B1HSD17B2 | |
| SCHEMBL833139 | 0.74 | ESR1 (0.56) | RPS6KA3VRK1ESR1ESR2CA1 | |
| SCHEMBL19390583 | 0.72 | VRK1 (0.53) | RPS6KA3VRK1ESR1ESR2ERN1 | |
| SCHEMBL16982130 | 0.71 | ESR1 (0.41) | RPS6KA3VRK1ESR1ESR2ERN1 | |
| SCHEMBL16982145 | 0.71 | ESR2 (0.50) | RPS6KA3VRK1ESR1ESR2CA1 | |
| SCHEMBL5528708 | 0.71 | CA1 (0.54) | CA1CA2HSD17B1HSD17B2TSHR | |
| SCHEMBL14087817 | 0.70 | NQO1 (0.61) | RPS6KA3VRK1ESR1ESR2CA1 | |
| SCHEMBL13446770 | 0.70 | RPS6KA3 (0.58) | RPS6KA3VRK1ESR1ESR2 | |
| SCHEMBL129716 | 0.69 | SELL (0.58) | RPS6KA3VRK1ESR1ESR2CA1 |
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-20040191602-A1 | Crosslinkable aromatic resin having protonic acid group, and ion conductive polymer membrane, binder and fuel cell using the resin | MITSUI CHEMICALS, INC. (JP) | 2004-09-30 | — | — | US | disclosed |