Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 10/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 7/20 | 0.48 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.48 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23912023 | 0.96 | CYP11B2 (0.46) | CYP11B2CYP11B1CYP17A1NEK1MAOA | |
| SCHEMBL20619436 | 0.93 | CYP11B2 (0.58) | CYP11B2CYP11B1CYP17A1NEK1MAOA | |
| SCHEMBL23912024 | 0.91 | CYP11B2 (0.48) | CYP11B2CYP11B1CYP17A1NEK1MAOA | |
| SCHEMBL20620088 | 0.91 | CYP11B2 (0.47) | CYP11B2CYP11B1CYP17A1MAOACYP1A2 | |
| SCHEMBL20620089 | 0.89 | CYP11B2 (0.51) | CYP11B2CYP11B1CYP17A1NEK1MAOA | |
| SCHEMBL20619444 | 0.89 | CYP11B2 (0.53) | CYP11B2CYP11B1CYP17A1NEK1MAOA | |
| SCHEMBL20619440 | 0.89 | CYP11B2 (0.46) | CYP11B2CYP11B1CYP17A1NEK1MAOA | |
| SCHEMBL23912092 | 0.87 | CYP11B2 (0.44) | CYP11B2CYP11B1CYP17A1MAOACYP1A2 | |
| SCHEMBL20620125 | 0.87 | CYP11B2 (0.49) | CYP11B2CYP11B1CYP17A1MAOACYP1A2 | |
| SCHEMBL20620056 | 0.86 | KMT2A (0.45) | CYP11B2CYP11B1CYP17A1MAOAKDM4E |
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-3645522-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2021-10-13 | — | — | EP | disclosed |