Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 4/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 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 | |
|---|---|---|---|---|
| SCHEMBL10032477 | 0.91 | GRM5 (0.40) | GRM5CYP2A6TGFBR1CYP11B2CYP11B1 | |
| SCHEMBL10032169 | 0.86 | MAPK14 (0.47) | CYP11B2CYP11B1CYP17A1CYP19A1MAPK14 | |
| SCHEMBL10032182 | 0.86 | CYP11B2 (0.55) | CYP2A6CYP11B2CYP11B1CYP17A1CYP19A1 | |
| SCHEMBL10032606 | 0.86 | KIF11 (0.41) | GRM5CYP2A6CYP11B2CYP11B1CYP17A1 | |
| SCHEMBL13015754 | 0.86 | CYP11B1 (0.47) | GRM5CYP2A6CYP11B2CYP11B1CYP17A1 | |
| SCHEMBL10032884 | 0.86 | GRM5 (0.43) | GRM5CYP2A6TGFBR1LMNAMAPT | |
| SCHEMBL10032734 | 0.85 | CYP2A6 (0.49) | CYP2A6CYP11B2CYP11B1CYP17A1CYP19A1 | |
| SCHEMBL10032667 | 0.85 | GRM5 (0.41) | GRM5TGFBR1DCTPP1LMNAMAPT | |
| SCHEMBL18174723 | 0.83 | CYP2A6 (0.43) | GRM5CYP2A6TGFBR1CYP11B2CYP11B1 | |
| SCHEMBL10032727 | 0.83 | TRPV1 (0.41) | GRM5CYP2A6CYP11B2CYP11B1CYP17A1 |
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 |