Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
| ▸ | WHR1 | P49842 | 1/20 | 0.34 |
| ▸ | CCR4 | P51679 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | HTR5A | P47898 | 1/20 | 0.32 |
| ▸ | NR1I3 | Q14994 | 3/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.31 |
| ▸ | AHR | P35869 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | VDR | P11473 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL21743651 | 0.94 | MEN1 (0.38) | MEN1KMT2AATMAURKAAURKB | |
| SCHEMBL21743407 | 0.91 | MEN1 (0.47) | MEN1KMT2AATMWHR1NR1I3 | |
| SCHEMBL24149316 | 0.91 | MEN1 (0.47) | MEN1KMT2AATMWHR1NR1I3 | |
| SCHEMBL21743646 | 0.90 | MEN1 (0.46) | MEN1KMT2AATMWHR1NR1I3 | |
| SCHEMBL21743402 | 0.89 | MEN1 (0.41) | MEN1KMT2AATMWHR1NR1I3 | |
| SCHEMBL24149318 | 0.88 | MEN1 (0.44) | MEN1KMT2AATMWHR1NR1I3 | |
| SCHEMBL24149521 | 0.87 | MEN1 (0.48) | MEN1KMT2AATMWHR1CYP1A2 | |
| SCHEMBL24149673 | 0.85 | MEN1 (0.46) | MEN1KMT2AATMWHR1ADORA2A | |
| SCHEMBL21743648 | 0.85 | MEN1 (0.34) | MEN1KMT2AATMAURKAAURKB | |
| SCHEMBL21743408 | 0.84 | MEN1 (0.47) | MEN1KMT2AATMWHR1NR1I3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020036313-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2020-02-20 | — | — | WO | disclosed |