Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 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 | |
|---|---|---|---|---|
| SCHEMBL2407762 | 0.95 | HPRT1 (0.43) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL2413446 | 0.88 | HPRT1 (0.43) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL2442730 | 0.88 | HPRT1 (0.39) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL534953 | 0.87 | HPRT1 (0.54) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL534978 | 0.83 | HPRT1 (0.61) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL28018139 | 0.83 | HPRT1 (0.61) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL25413 | 0.82 | ALDH1A1 (0.57) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL27528926 | 0.81 | ALDH1A1 (0.55) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL2409023 | 0.79 | HPRT1 (0.35) | HPRT1 | |
| SCHEMBL2408906 | 0.76 | HPRT1 (0.41) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR |
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 |