Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 4/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | USP8 | P40818 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.43 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4270686 | 0.85 | CYP2A6 (0.62) | CYP11B1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL30335566 | 0.85 | CYP2A6 (0.62) | CYP11B1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL3785592 | 0.83 | CYP11B1 (0.53) | CYP11B1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL30026143 | 0.82 | CYP2A6 (0.70) | CYP11B1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL20541087 | 0.82 | CYP2A6 (0.70) | CYP11B1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL2750976 | 0.81 | CYP11B1 (0.51) | CYP11B1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL472043 | 0.81 | CYP2A6 (0.61) | CYP11B1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL29543420 | 0.81 | CYP2A6 (0.61) | CYP11B1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL12853987 | 0.80 | CYP2A6 (0.67) | CYP11B1CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL21110859 | 0.80 | CYP2A6 (0.67) | CYP11B1CYP2A6ALDH1A1CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2331654-A1 | ELECTRON-TRANSPORTING MATERIALS | General Electric Company (US) | 2011-06-15 | — | — | EP | disclosed |