Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 4/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | EDNRB | P24530 | 1/20 | 0.40 |
| ▸ | EDNRA | P25101 | 1/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
| ▸ | SHMT1 | P34896 | 1/20 | 0.39 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27277199 | 0.92 | AHR (0.53) | AHRNPSR1NPC1ALDH1A1TP53 | |
| SCHEMBL510771 | 0.77 | AHR (0.61) | AHRNPSR1NPC1ALDH1A1TP53 | |
| SCHEMBL29788257 | 0.77 | AHR (0.61) | AHRNPSR1NPC1ALDH1A1TP53 | |
| SCHEMBL17165539 | 0.76 | MAPT (0.44) | AHRNPSR1NPC1ALDH1A1HPGD | |
| SCHEMBL16863586 | 0.76 | AHR (0.54) | AHRNPC1TP53TSHRRAB9A | |
| SCHEMBL27277425 | 0.76 | AHR (0.59) | AHRSMN1; SMN2ESR2 | |
| SCHEMBL27277506 | 0.76 | MAPK1 (0.44) | AHRNPSR1NPC1TP53HPGD | |
| SCHEMBL25818508 | 0.76 | AHR (0.50) | AHRNPSR1ALDH1A1TP53TSHR | |
| SCHEMBL27277431 | 0.75 | MEN1 (0.44) | NPSR1NPC1ALDH1A1TP53HPGD | |
| Methane SCHEMBL28774809 | 0.74 | AHR (0.57) | AHRNPSR1NPC1ALDH1A1TP53 |
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-2024101948-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2024-05-16 | — | — | WO | disclosed |