Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.48 |
| ▸ | CYP17A1 | P05093 | 7/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.44 |
| ▸ | COMT | P21964 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.40 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 3/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9612833 | 0.96 | CYP17A1 (0.49) | DHODHCYP17A1CYP1A2COMTCYP11B1 | |
| SCHEMBL18174770 | 0.93 | DHODH (0.49) | DHODHCYP17A1CYP1A2CYP11B1CYP11B2 | |
| SCHEMBL9612942 | 0.93 | DHODH (0.52) | DHODHCYP17A1CYP1A2CYP11B1CYP11B2 | |
| SCHEMBL18174788 | 0.91 | DHODH (0.50) | DHODHCYP17A1CYP1A2CYP11B1CYP11B2 | |
| SCHEMBL9613042 | 0.91 | DHODH (0.46) | DHODHCYP17A1CYP1A2CYP11B1CYP11B2 | |
| SCHEMBL18174554 | 0.89 | DHODH (0.52) | DHODHCYP17A1CYP1A2CYP11B1CYP11B2 | |
| SCHEMBL18174773 | 0.89 | DHODH (0.49) | DHODHCYP17A1CYP1A2CYP11B1CYP11B2 | |
| SCHEMBL18174789 | 0.88 | DHODH (0.46) | DHODHCYP17A1CYP1A2CYP11B1CYP11B2 | |
| SCHEMBL18174785 | 0.87 | DHODH (0.47) | DHODHCYP17A1CYP1A2CYP11B1CYP11B2 | |
| SCHEMBL18174771 | 0.87 | DHODH (0.47) | DHODHCYP17A1CYP1A2COMTCYP11B1 |
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 |