Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | FASN | P49327 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL25036140 | 0.97 | ADORA2A (0.35) | ADORA2AADORA1FASNTRPA1ABL1 | |
| SCHEMBL25036035 | 0.92 | ABCG2 (0.36) | ALDH1A1CYP11B1CYP11B2MEN1CYP1A2 | |
| SCHEMBL25038875 | 0.92 | CYP11B1 (0.36) | ADORA2AADORA1FASNTRPA1ALDH1A1 | |
| SCHEMBL25038649 | 0.91 | ADORA2A (0.37) | ADORA2AADORA1FASNTRPA1ABL1 | |
| SCHEMBL25036118 | 0.91 | CYP11B1 (0.37) | ADORA2AADORA1FASNTRPA1ABL1 | |
| SCHEMBL25038415 | 0.89 | ADORA2A (0.35) | ADORA2AADORA1FASNTRPA1ABL1 | |
| SCHEMBL25036051 | 0.89 | ADORA2A (0.39) | ADORA2AADORA1FASNTRPA1PIM1 | |
| SCHEMBL25038490 | 0.88 | ABCG2 (0.35) | ALDH1A1CYP11B1CYP11B2GABRA1GABRG2 | |
| SCHEMBL25038365 | 0.88 | ADORA2A (0.35) | ADORA2AADORA1FASNTRPA1ABL1 | |
| SCHEMBL25037999 | 0.88 | SSTR2 (0.34) | ADORA2AADORA1TRPA1ABL1CYP11B1 |
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 |