Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GPR3 | P46089 | 1/20 | 0.35 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.35 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | BRD4 | O60885 | 2/20 | 0.34 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.34 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21414201 | 0.93 | GPR3 (0.36) | TP53MAPTGPR3ALKBH5FTO | |
| SCHEMBL21928428 | 0.91 | CYP11B2 (0.38) | TP53MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL21547036 | 0.90 | KIF11 (0.43) | TP53MAPTALKBH5FTOCYP1A2 | |
| SCHEMBL21546741 | 0.90 | ALKBH5 (0.40) | TP53MAPTGPR3ALKBH5FTO | |
| SCHEMBL20616850 | 0.88 | KIF11 (0.46) | TP53MAPTCYP1A2MEN1ALDH1A1 | |
| SCHEMBL22761108 | 0.88 | CFTR (0.33) | TP53MAPTBRD4ALDH1A1MAPK1 | |
| SCHEMBL21546485 | 0.87 | CYP11B2 (0.36) | TP53MAPTGPR3ALKBH5FTO | |
| SCHEMBL21546635 | 0.87 | KDM4E (0.39) | TP53MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL22564577 | 0.87 | KIF11 (0.44) | MAPTGPR3MEN1ALDH1A1KMT2A | |
| SCHEMBL22761041 | 0.85 | CYP1A2 (0.34) | TP53MAPTGPR3ALKBH5FTO |
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 |