Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2407426 | 0.90 | ALDH1A1 (0.35) | HPRT1ALDH1A1HSD17B10CYP1A2THRB | |
| SCHEMBL534974 | 0.84 | HPRT1 (0.58) | HPRT1ALDH1A1HSD17B10CYP1A2THRB | |
| SCHEMBL534952 | 0.84 | HPRT1 (0.58) | HPRT1ALDH1A1HSD17B10CYP1A2THRB | |
| SCHEMBL2409576 | 0.84 | HPRT1 (0.39) | HPRT1ALDH1A1HSD17B10CYP1A2THRB | |
| SCHEMBL2412656 | 0.83 | HPRT1 (0.33) | HPRT1 | |
| SCHEMBL25108 | 0.79 | ALDH1A1 (0.55) | HPRT1ALDH1A1HSD17B10CYP1A2THRB | |
| SCHEMBL18317169 | 0.79 | CYP1A2 (0.48) | HPRT1ALDH1A1HSD17B10CYP1A2THRB | |
| SCHEMBL2411016 | 0.78 | CYP1A2 (0.32) | CYP1A2CYP2A6 | |
| SCHEMBL14718717 | 0.78 | ALDH1A1 (0.47) | HPRT1ALDH1A1HSD17B10CYP1A2THRB | |
| SCHEMBL12080528 | 0.78 | HSD17B10 (0.47) | HPRT1ALDH1A1HSD17B10CYP1A2THRB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011105700-A1 | NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2011-09-01 | — | — | WO | disclosed |