Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.35 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.35 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.34 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22562217 | 0.98 | KDM4E (0.36) | KDM4EMAPTL3MBTL1ADORA2AADORA1 | |
| SCHEMBL22562215 | 0.92 | KDM4E (0.38) | KDM4EMAPTL3MBTL1ADORA2AADORA1 | |
| SCHEMBL22562352 | 0.92 | CYP11B1 (0.38) | KDM4EMAPTL3MBTL1ADORA2AADORA1 | |
| SCHEMBL22562241 | 0.89 | ALDH1A3 (0.39) | ADORA2ACYP1A2CYP2C9CYP2C19TGFBR1 | |
| SCHEMBL22562556 | 0.88 | MYC (0.40) | KDM4ESMN1; SMN2HIF1AALDH1A3CYP11B1 | |
| SCHEMBL22562554 | 0.87 | ALDH1A3 (0.38) | ADORA2ACYP1A2CYP2C9CYP2C19TGFBR1 | |
| SCHEMBL22562242 | 0.85 | CYP1A2 (0.34) | KDM4EMAPTL3MBTL1ADORA2AADORA1 | |
| SCHEMBL22562216 | 0.84 | KDM4E (0.41) | KDM4EMAPTL3MBTL1ADORA2AADORA1 | |
| SCHEMBL22562544 | 0.84 | ADORA1 (0.41) | KDM4EMAPTL3MBTL1ADORA2AADORA1 | |
| SCHEMBL22562351 | 0.84 | CLK4 (0.40) | KDM4EMAPTL3MBTL1ADORA2ANPSR1 |
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 |