Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25037992 | 0.90 | FASN (0.41) | MCL1CYP1A2CYP2C9CYP2C19SSTR2 | |
| SCHEMBL25038656 | 0.90 | PTGES (0.37) | MCL1CYP1A2CYP2C9CYP2C19SSTR2 | |
| SCHEMBL25036084 | 0.90 | MCL1 (0.43) | MCL1CYP1A2CYP2C9CYP2C19SSTR2 | |
| SCHEMBL25036034 | 0.89 | MCL1 (0.41) | MCL1CYP1A2CYP2C9CYP2C19CA1 | |
| SCHEMBL25038348 | 0.88 | MCL1 (0.37) | MCL1SSTR2CA1CA2CYP11B1 | |
| SCHEMBL25038403 | 0.87 | MCL1 (0.42) | MCL1CYP1A2CYP2C9CYP2C19SSTR2 | |
| SCHEMBL25036050 | 0.87 | MCL1 (0.37) | MCL1CYP1A2CYP2C9CYP2C19SSTR2 | |
| SCHEMBL25038628 | 0.87 | XDH (0.44) | MCL1CYP1A2CYP2C9CYP2C19CA1 | |
| SCHEMBL25775229 | 0.86 | ESR2 (0.41) | CYP1A2CYP2C9CYP2C19SSTR2CYP11B1 | |
| SCHEMBL25036139 | 0.86 | MCL1 (0.40) | MCL1CYP1A2CYP2C9CYP2C19CA1 |
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-2023018267-A1 | NOVEL COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2023-02-16 | — | — | WO | disclosed |