Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | FASN | P49327 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25038468 | 0.96 | CYP11B1 (0.34) | ADORA2AADORA1ALDH1A1TP53HSD17B10 | |
| SCHEMBL25036118 | 0.96 | CYP11B1 (0.37) | ADORA2AADORA1ALDH1A1TP53HSD17B10 | |
| SCHEMBL25036140 | 0.92 | ADORA2A (0.35) | ADORA2AADORA1ALDH1A1TP53HSD17B10 | |
| SCHEMBL25038603 | 0.92 | XDH (0.38) | ADORA2AADORA1ALDH1A1TP53HSD17B10 | |
| SCHEMBL25038466 | 0.91 | CYP11B1 (0.40) | ALDH1A1TP53HSD17B10HPGDTSHR | |
| SCHEMBL25036088 | 0.90 | ADORA2A (0.35) | ADORA2AADORA1ALDH1A1TP53HSD17B10 | |
| SCHEMBL25038873 | 0.90 | PIM1 (0.37) | ADORA2AADORA1ALDH1A1TP53HSD17B10 | |
| SCHEMBL25036044 | 0.89 | ADORA2A (0.37) | ADORA2AADORA1ALDH1A1TP53HSD17B10 | |
| SCHEMBL25038485 | 0.89 | PIM1 (0.38) | ADORA2AADORA1ALDH1A1TP53HSD17B10 | |
| SCHEMBL25038877 | 0.88 | CYP11B1 (0.36) | ALDH1A1TP53HSD17B10HPGDTSHR |
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 |