Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | WHR1 | P49842 | 1/20 | 0.41 |
| ▸ | NUDT1 | P36639 | 3/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.37 |
| ▸ | NR1I3 | Q14994 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL21743646 | 0.99 | MEN1 (0.46) | MEN1KMT2AATMWHR1NUDT1 | |
| SCHEMBL24149521 | 0.95 | MEN1 (0.48) | MEN1KMT2AATMWHR1NUDT1 | |
| SCHEMBL24149316 | 0.95 | MEN1 (0.47) | MEN1KMT2AATMWHR1NUDT1 | |
| SCHEMBL21743402 | 0.93 | MEN1 (0.41) | MEN1KMT2AATMWHR1NUDT1 | |
| SCHEMBL24149673 | 0.93 | MEN1 (0.46) | MEN1KMT2AATMWHR1NUDT1 | |
| SCHEMBL21743408 | 0.93 | MEN1 (0.47) | MEN1KMT2AATMWHR1NUDT1 | |
| SCHEMBL24149318 | 0.92 | MEN1 (0.44) | MEN1KMT2AATMWHR1ADORA2A | |
| SCHEMBL21743650 | 0.91 | MEN1 (0.38) | MEN1KMT2AATMWHR1ADORA2A | |
| SCHEMBL24648354 | 0.90 | MEN1 (0.46) | MEN1KMT2AATMWHR1NUDT1 | |
| SCHEMBL24647466 | 0.89 | MEN1 (0.45) | MEN1KMT2AATMWHR1NUDT1 |
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 |