Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 9/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 9/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.46 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.46 |
| ▸ | VSIR | Q9H7M9 | 1/20 | 0.46 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.44 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.44 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27403962 | 0.96 | ESR1 (0.52) | ESR1ESR2GPR119CASP3SENP8 | |
| SCHEMBL27401205 | 0.83 | ESR1 (0.44) | ESR1ESR2VSIRGPR119CASP3 | |
| SCHEMBL27403408 | 0.83 | HSD17B1 (0.42) | ESR1ESR2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27401323 | 0.81 | GPR119 (0.43) | ESR1ESR2VSIRGPR119CASP3 | |
| SCHEMBL27403350 | 0.80 | KDM4E (0.52) | ESR1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL29202870 | 0.80 | ESR1 (0.56) | ESR1ESR2VSIRGPR119NPC1 | |
| SCHEMBL27401329 | 0.79 | ESR1 (0.43) | ESR1ESR2VSIRGPR119CASP3 | |
| SCHEMBL27401322 | 0.79 | GPR119 (0.44) | ESR1ESR2VSIRGPR119CASP3 | |
| SCHEMBL27401212 | 0.79 | ESR1 (0.43) | ESR1ESR2VSIRGPR119NPC1 | |
| SCHEMBL18999523 | 0.79 | GPR119 (0.47) | ESR1ESR2VSIRGPR119CASP3 |
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-2024122840-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2024-06-13 | — | — | WO | disclosed |