Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CA9 | Q16790 | 3/20 | 0.33 |
| ▸ | PIM1 | P11309 | 2/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.31 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 3/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.31 |
| ▸ | PPARG | P37231 | 3/20 | 0.30 |
| ▸ | PPARA | Q07869 | 3/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.30 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.30 |
| ▸ | PPARD | Q03181 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13344667 | 0.99 | CA12 (0.33) | CA12CA1CA2CA9PIM1 | |
| SCHEMBL13304259 | 0.96 | PIM1 (0.33) | CA12CA1CA2CA9PIM1 | |
| SCHEMBL12796261 | 0.94 | CA12 (0.37) | CA12CA1CA2CA9PIM1 | |
| SCHEMBL12796220 | 0.93 | HSD17B1 (0.35) | CA1CA2CA9HSD17B1HSD17B2 | |
| SCHEMBL12796213 | 0.93 | ESR1 (0.35) | CA1CA2CA9HSD17B1HSD17B2 | |
| SCHEMBL12796274 | 0.93 | ESR1 (0.35) | CA1CA2CA9HSD17B1HSD17B2 | |
| SCHEMBL13345191 | 0.91 | CA12 (0.39) | CA12CA1CA2CA9HSD17B1 | |
| SCHEMBL13304227 | 0.91 | HSD17B1 (0.35) | HSD17B1HSD17B2SOS1ESR1ESR2 | |
| SCHEMBL12796204 | 0.91 | HDAC4 (0.35) | CA12CA1CA2CA9PIM1 | |
| SCHEMBL12796254 | 0.91 | ESR1 (0.34) | HSD17B1HSD17B2ALDH1A1SOS1ESR1 |
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-2010064871-A1 | NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME | GRACEL DISPLAY INC. (KR) | 2010-06-10 | — | — | WO | disclosed |