Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | PPARD | Q03181 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | CNR1 | P21554 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | TNKS | O95271 | 2/20 | 0.36 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL215399 | 0.84 | XDH (0.50) | XDHALDH1A1GABRA1GABRB2MAPT | |
| SCHEMBL12802571 | 0.78 | ALDH1A1 (0.39) | XDHALDH1A1GABRA1GABRB2MAPT | |
| SCHEMBL16744053 | 0.78 | ALDH1A1 (0.39) | XDHALDH1A1GABRA1GABRB2MAPT | |
| SCHEMBL12802272 | 0.78 | TSHR (0.43) | ALDH1A1CNR1CNR2CYP3A4TSHR | |
| SCHEMBL12802091 | 0.78 | TSHR (0.38) | ALDH1A1TSHRRXRA | |
| SCHEMBL1245519 | 0.76 | XDH (0.44) | XDHALDH1A1GABRA1GABRB2MAPT | |
| SCHEMBL12802457 | 0.75 | TSHR (0.48) | ALDH1A1HPGDNPSR1CYP3A4TSHR | |
| SCHEMBL12802012 | 0.75 | NPC1 (0.45) | XDHALDH1A1PPARGPPARDCNR2 | |
| SCHEMBL8857437 | 0.75 | ALDH1A1 (0.45) | XDHALDH1A1GABRA1GABRB2MAPT | |
| SCHEMBL29080413 | 0.73 | TLR8 (0.32) | — |
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-5185419-A | POLY(ARYLENEVINYLENESILOXANES) COMPOUNDS | CONSORTIUM FUR ELEKTROCHEMISCHE GMBH (DE) | 1993-02-09 | — | — | US | disclosed |