Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 2/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.35 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.33 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.33 |
| ▸ | GPR3 | P46089 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21414299 | 0.93 | EGFR (0.38) | CYP11B2EGFRSRCMAPTNQO2 | |
| SCHEMBL21546495 | 0.89 | ALKBH5 (0.39) | CYP11B2EGFRSRCGRIA2GRIA4 | |
| SCHEMBL21547164 | 0.89 | KIF11 (0.39) | TP53MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL21547048 | 0.88 | KDM4E (0.38) | TP53MAPTADORA2AADORA1ADORA2B | |
| SCHEMBL22760789 | 0.88 | CFTR (0.33) | GRIA2GRIA4TP53MAPTALDH1A1 | |
| SCHEMBL21546739 | 0.87 | TP53 (0.35) | CYP11B2GRIA2GRIA4TP53MAPT | |
| SCHEMBL25903074 | 0.87 | KDM4E (0.37) | TP53MAPTADORA2AADORA1ADORA2B | |
| SCHEMBL21547053 | 0.86 | CYP11B2 (0.34) | CYP11B2EGFRSRCGRIA2GRIA4 | |
| SCHEMBL20617093 | 0.86 | KIF11 (0.43) | CYP11B2EGFRSRCNQO2GPR3 | |
| SCHEMBL25903340 | 0.86 | KDM4E (0.36) | TP53MAPTADORA2AADORA1ADORA2B |
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-3478793-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2019-11-06 | — | — | EP | disclosed |