Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PDE6D | O43924 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | PRKDC | P78527 | 1/20 | 0.31 |
| ▸ | PDE5A | O76074 | 1/20 | 0.30 |
| ▸ | PDE4A | P27815 | 1/20 | 0.30 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.30 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.30 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.30 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.30 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.30 |
| ▸ | COMT | P21964 | 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 | |
|---|---|---|---|---|
| SCHEMBL15088815 | 0.94 | PIK3CA (0.36) | CYP19A1PIK3CAPDE6DCYP17A1CYP11B1 | |
| SCHEMBL15088797 | 0.92 | CYP19A1 (0.40) | CYP19A1DHODHPIK3CAPDE6DCYP17A1 | |
| SCHEMBL15088917 | 0.90 | CYP19A1 (0.34) | CYP19A1DHODHPIK3CAPRKDC | |
| SCHEMBL15088955 | 0.88 | CYP2A6 (0.36) | CYP19A1DHODHPDE6DPRKDC | |
| SCHEMBL15089286 | 0.88 | PDE6D (0.40) | PIK3CAPDE6DCOMT | |
| SCHEMBL15088787 | 0.87 | CYP11B1 (0.35) | CYP19A1PIK3CAPDE6DCYP17A1CYP11B1 | |
| SCHEMBL15088795 | 0.87 | PDE6D (0.37) | PDE6D | |
| SCHEMBL15088786 | 0.86 | PDE6D (0.38) | PDE6D | |
| SCHEMBL15089361 | 0.86 | PDE6D (0.35) | PDE6DCOMT | |
| SCHEMBL15089026 | 0.86 | PDE6D (0.35) | PDE6DCOMT |
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-2013100497-A1 | ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME | 주식회사 두산 (KR) | 2013-07-04 | — | — | WO | disclosed |