Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 4/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25038662 | 0.93 | ABCG2 (0.37) | XDHALDH1A1LMNAGRM5 | |
| SCHEMBL25037999 | 0.93 | SSTR2 (0.34) | CYP11B1CYP11B2GRM5NPSR1ADORA2A | |
| SCHEMBL25038875 | 0.93 | CYP11B1 (0.36) | CYP11B1CYP11B2ALDH1A1KDM4EHTT | |
| SCHEMBL25038607 | 0.92 | ABCG2 (0.37) | XDHALDH1A1LMNAGRM5 | |
| SCHEMBL25038649 | 0.92 | ADORA2A (0.37) | XDHALDH1A1KDM4EGRM5ADORA2A | |
| SCHEMBL25038613 | 0.91 | ADORA2A (0.37) | XDHALDH1A1KDM4EHTTRXFP1 | |
| SCHEMBL25038574 | 0.89 | XDH (0.39) | XDHALDH1A1KDM4EHTTRXFP1 | |
| SCHEMBL26581948 | 0.89 | XDH (0.43) | XDHCYP11B1CYP11B2ALDH1A1KDM4E | |
| SCHEMBL25037887 | 0.88 | ABCG2 (0.37) | XDHGRM5 | |
| SCHEMBL25038420 | 0.87 | CYP1A2 (0.39) | ALDH1A1KDM4ELMNAADORA2AADORA1 |
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 |