Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22760629 | 1.00 | ADORA2A (0.36) | ADORA2AADRA2CCYP1A2ALDH1A1LMNA | |
| SCHEMBL22760720 | 1.00 | ADORA2A (0.36) | ADORA2AADRA2CCYP1A2ALDH1A1LMNA | |
| SCHEMBL21546937 | 0.93 | ADORA2A (0.36) | ADORA2AADRA2CCYP1A2ALDH1A1LMNA | |
| SCHEMBL21547051 | 0.93 | ADORA2A (0.36) | ADORA2AADRA2CCYP1A2ALDH1A1LMNA | |
| SCHEMBL22760628 | 0.93 | ADORA2A (0.36) | ADORA2AADRA2CCYP1A2ALDH1A1LMNA | |
| SCHEMBL22760608 | 0.93 | ADORA2A (0.36) | ADORA2AADRA2CCYP1A2ALDH1A1LMNA | |
| SCHEMBL19579218 | 0.93 | ADRA2C (0.39) | ADORA2AADRA2CCYP1A2ALDH1A1LMNA | |
| SCHEMBL21547067 | 0.92 | ADORA2A (0.38) | ADORA2AADRA2CCYP1A2ALDH1A1LMNA | |
| SCHEMBL22760963 | 0.91 | ALDH1A3 (0.39) | ADORA2AADRA2CCYP1A2ALDH1A1LMNA | |
| SCHEMBL22760718 | 0.89 | ALDH1A3 (0.40) | ADORA2AADRA2CCYP1A2ALDH1A1LMNA |
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 |