Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.41 |
| ▸ | CCR4 | P51679 | 1/20 | 0.37 |
| ▸ | WHR1 | P49842 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.35 |
| ▸ | AHR | P35869 | 2/20 | 0.35 |
| ▸ | NR1I3 | Q14994 | 2/20 | 0.35 |
| ▸ | VDR | P11473 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ACACA | Q13085 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23936028 | 0.93 | MEN1 (0.44) | MEN1KMT2AATMAURKAAURKB | |
| SCHEMBL23936112 | 0.90 | MEN1 (0.51) | MEN1KMT2AATMWHR1CYP1A2 | |
| SCHEMBL23936442 | 0.88 | MEN1 (0.44) | MEN1KMT2AATMWHR1CYP1A2 | |
| SCHEMBL23935949 | 0.87 | KMT2A (0.38) | MEN1KMT2AATMAURKAAURKB | |
| SCHEMBL21667456 | 0.86 | ATM (0.42) | MEN1KMT2AATMAURKAAURKB | |
| SCHEMBL23936455 | 0.85 | AURKA (0.38) | MEN1KMT2AATMAURKAAURKB | |
| SCHEMBL22186720 | 0.84 | ATM (0.40) | MEN1KMT2AATMAURKAAURKB | |
| SCHEMBL23936747 | 0.84 | MEN1 (0.52) | MEN1KMT2AATMWHR1CYP1A2 | |
| SCHEMBL21667419 | 0.84 | ATM (0.46) | MEN1KMT2AATMWHR1CYP1A2 | |
| SCHEMBL23935972 | 0.84 | MEN1 (0.42) | MEN1KMT2ACYP1A2ADORA2AALDH1A1 |
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-20210328150-A1 | ORGANIC ELECTROLUMINESCENT COMPOUND, ORGANIC ELECTROLUMINESCENT MATERIAL COMPRISING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE | DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) | 2021-10-21 | — | — | US | disclosed |