Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 1/20 | 0.37 |
| ▸ | FEN1 | P39748 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | EDNRB | P24530 | 1/20 | 0.36 |
| ▸ | EDNRA | P25101 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | TRPV3 | Q8NET8 | 2/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | TOP1 | P11387 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22562613 | 0.97 | ALOX5AP (0.39) | ALOX5APFEN1CYP2C9SCN9AEDNRB | |
| SCHEMBL22562450 | 0.94 | ALOX5AP (0.37) | ALOX5APFEN1CYP2C9SCN9AEDNRB | |
| SCHEMBL22562418 | 0.93 | KIF11 (0.36) | CYP11B2KIF11TOP1CDK2GSK3B | |
| SCHEMBL22562606 | 0.91 | CTSS (0.36) | ALOX5APFEN1CYP2C9SCN9AEDNRB | |
| SCHEMBL22562292 | 0.90 | CYP11B2 (0.39) | CYP11B2TRPA1CDK2MEN1KMT2A | |
| SCHEMBL22562415 | 0.90 | CYP11B2 (0.38) | CYP2C9SCN9ACYP11B2TRPV3TOP1 | |
| SCHEMBL22562222 | 0.90 | ALOX5AP (0.37) | ALOX5APFEN1CYP2C9SCN9AEDNRB | |
| SCHEMBL22562413 | 0.89 | KIF11 (0.41) | CYP2C9CYP11B2KIF11TOP1CDK2 | |
| SCHEMBL22562346 | 0.88 | CTSS (0.38) | ALOX5APFEN1CYP2C9SCN9AEDNRB | |
| SCHEMBL22562458 | 0.87 | TRPV1 (0.35) | CYP11B2KIF11TRPA1TOP1GSK3B |
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 |