Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 3/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10032619 | 0.93 | CCR1 (0.39) | CYP17A1CYP19A1CYP11B1CYP11B2CCR1 | |
| SCHEMBL10032185 | 0.88 | CYP11B2 (0.42) | CYP17A1CYP19A1CYP11B1CYP11B2CCR1 | |
| SCHEMBL10032424 | 0.87 | CYP2A6 (0.42) | CYP17A1CYP19A1CYP11B1CYP11B2CCR1 | |
| SCHEMBL10032217 | 0.86 | CYP11B2 (0.44) | CYP17A1CYP19A1CYP11B1CYP11B2HSD17B1 | |
| SCHEMBL13016369 | 0.86 | CYP11B1 (0.47) | CYP17A1CYP19A1CYP11B1CYP11B2CCR1 | |
| SCHEMBL10032484 | 0.86 | CYP2A6 (0.41) | CYP17A1CYP19A1CYP11B1CYP11B2CCR1 | |
| SCHEMBL10032497 | 0.86 | CCR1 (0.44) | CCR1CCR8TGFBR1HSD17B1HSD17B2 | |
| SCHEMBL10032871 | 0.86 | CCR1 (0.43) | CCR1CCR8TGFBR1HSD17B1HSD17B2 | |
| SCHEMBL10032750 | 0.85 | CYP2A6 (0.40) | CYP17A1CYP19A1CYP11B1CYP11B2CCR1 | |
| SCHEMBL10032188 | 0.84 | CYP11B2 (0.50) | CYP17A1CYP19A1CYP11B1CYP11B2HSD17B1 |
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-2012060374-A1 | ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME | JNC株式会社 (JP) | 2012-05-10 | — | — | WO | disclosed |