Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 1/20 | 0.32 |
| ▸ | CCND3 | P30281 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | TOP1 | P11387 | 1/20 | 0.32 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.31 |
| ▸ | ACP1 | P24666 | 2/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22562459 | 0.95 | KIF11 (0.37) | TRPV1CYP11B2S1PR1S1PR3PPARG | |
| SCHEMBL22562418 | 0.94 | KIF11 (0.36) | TRPV1CYP11B2S1PR1S1PR3PPARG | |
| SCHEMBL22562457 | 0.92 | CYP11B2 (0.36) | TRPV1CYP11B2KIF11MEN1RAB9A | |
| SCHEMBL22562415 | 0.91 | CYP11B2 (0.38) | TRPV1CYP11B2MEN1RAB9AKMT2A | |
| SCHEMBL22562592 | 0.89 | PTGDR2 (0.35) | CYP11B2S1PR1S1PR3MEN1RAB9A | |
| SCHEMBL22562292 | 0.89 | CYP11B2 (0.39) | CYP11B2MEN1RAB9AKMT2AESR1 | |
| SCHEMBL22562499 | 0.88 | CYP11B2 (0.36) | CYP11B2S1PR1S1PR3MEN1RAB9A | |
| SCHEMBL22562413 | 0.88 | KIF11 (0.41) | TRPV1CYP11B2PPARGPPARAKIF11 | |
| SCHEMBL22562502 | 0.88 | CYP11B2 (0.36) | CYP11B2S1PR1S1PR3MEN1RAB9A | |
| SCHEMBL22562490 | 0.87 | KIF11 (0.36) | TRPV1CYP11B2PPARGPPARAKIF11 |
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-3418278-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2020-10-21 | — | — | EP | disclosed |