Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | WHR1 | P49842 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22868561 | 0.95 | CYP1A1 (0.35) | CYP1A1CYP1A2CYP1B1WHR1MEN1 | |
| SCHEMBL22868899 | 0.88 | ALDH1A1 (0.32) | CYP1A1CYP1A2CYP1B1MEN1KMT2A | |
| SCHEMBL22868650 | 0.88 | MEN1 (0.45) | CYP1A2WHR1MEN1KMT2AATM | |
| SCHEMBL22186236 | 0.88 | CYP1A1 (0.32) | CYP1A1CYP1A2CYP1B1MEN1KMT2A | |
| SCHEMBL22868568 | 0.87 | CYP1A1 (0.34) | CYP1A1CYP1A2CYP1B1WHR1MEN1 | |
| SCHEMBL22868567 | 0.86 | MAPT (0.35) | CYP1A2WHR1MEN1KMT2AATM | |
| SCHEMBL22869015 | 0.85 | MEN1 (0.35) | CYP1A1CYP1A2CYP1B1WHR1MEN1 | |
| SCHEMBL22868732 | 0.85 | CYP1A1 (0.34) | CYP1A1CYP1A2CYP1B1WHR1MEN1 | |
| SCHEMBL22868807 | 0.85 | SOS1 (0.35) | CYP1A1CYP1A2CYP1B1MEN1KMT2A | |
| SCHEMBL22868783 | 0.84 | ESR1 (0.36) | CYP1A2WHR1MEN1KMT2AATM |
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 |
|---|---|---|---|---|---|---|---|
| US-20210005822-A1 | ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | DUPONT SPECIALTY MATERIALS KOREA LTD (KR) | 2021-01-07 | — | — | US | disclosed |