Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 10/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 8/20 | 0.49 |
| ▸ | DHODH | Q02127 | 1/20 | 0.47 |
| ▸ | TNF | P01375 | 1/20 | 0.41 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.39 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | BTK | Q06187 | 1/20 | 0.38 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | COMT | P21964 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9612957 | 0.96 | DHODH (0.48) | CYP17A1CYP1A2DHODHCYP11B1CYP11B2 | |
| SCHEMBL9612963 | 0.90 | CYP17A1 (0.50) | CYP17A1CYP1A2DHODHTNFCYP11B1 | |
| SCHEMBL9613042 | 0.90 | DHODH (0.46) | CYP17A1CYP1A2DHODHTNFCYP11B1 | |
| SCHEMBL9612927 | 0.89 | DHODH (0.50) | CYP17A1CYP1A2DHODHTNFENPP1 | |
| SCHEMBL9612942 | 0.89 | DHODH (0.52) | CYP17A1CYP1A2DHODHTNFCYP11B1 | |
| SCHEMBL18174770 | 0.89 | DHODH (0.49) | CYP17A1CYP1A2DHODHTNFCYP11B1 | |
| SCHEMBL18174554 | 0.88 | DHODH (0.52) | CYP17A1CYP1A2DHODHCYP11B1CYP11B2 | |
| SCHEMBL18174788 | 0.87 | DHODH (0.50) | CYP17A1CYP1A2DHODHCYP11B1CYP11B2 | |
| SCHEMBL10017328 | 0.85 | CYP17A1 (0.45) | CYP17A1CYP1A2DHODHTNFENPP1 | |
| SCHEMBL18174773 | 0.85 | DHODH (0.49) | CYP17A1CYP1A2DHODHCYP11B1CYP11B2 |
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-2012070535-A1 | ELECTRON TRANSPORT MATERIAL, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME | JNC株式会社 (JP) | 2012-05-31 | — | — | WO | disclosed |