Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.39 |
| ▸ | CTRC | Q99895 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | AXL | P30530 | 1/20 | 0.38 |
| ▸ | CDK8 | P49336 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12436954 | 0.94 | CYP1A1 (0.46) | CYP1A1CYP1B1CYP11B1CYP11B2ADORA2A | |
| SCHEMBL12436195 | 0.93 | HSD17B1 (0.44) | CYP1A1CYP1B1CYP11B1CYP11B2ADORA2A | |
| SCHEMBL12436885 | 0.93 | CYP1A1 (0.47) | CYP1A1CYP1B1CYP11B1CYP11B2ADORA2A | |
| SCHEMBL28223699 | 0.91 | HSD17B1 (0.44) | CYP1A1CYP1B1CYP11B1CYP11B2ADORA2A | |
| SCHEMBL12436891 | 0.90 | CYP1A1 (0.47) | CYP1A1CYP1B1CYP11B1CYP11B2ADORA2A | |
| SCHEMBL17680014 | 0.90 | CYP11B1 (0.46) | CYP1A1CYP1B1CYP11B1CYP11B2CYP1A2 | |
| SCHEMBL21249207 | 0.88 | CYP11B1 (0.45) | CYP1A1CYP1B1CYP11B1CYP11B2CYP1A2 | |
| SCHEMBL15977420 | 0.87 | CYP1A1 (0.43) | CYP1A1CYP1B1CYP11B1CYP11B2ADORA2A | |
| SCHEMBL24686653 | 0.86 | CYP11B1 (0.53) | CYP1A1CYP1B1CYP11B1CYP11B2ADORA2A | |
| SCHEMBL12436956 | 0.86 | CYP1A1 (0.42) | CYP1A1CYP1B1CYP11B1CYP11B2ADORA2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011037380-A9 | NOVEL ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME | 주식회사 두산 (KR) | 2011-08-04 | — | — | WO | disclosed |
| WO-2011037380-A2 | NOVEL ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME | 주식회사 두산 (KR) | 2011-03-31 | — | — | WO | disclosed |