Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2D | O15399 | 1/20 | 0.55 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.55 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.55 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.55 |
| ▸ | HSD17B1 | P14061 | 4/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.47 |
| ▸ | ESR1 | P03372 | 7/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1527510 | 0.91 | GRIN2D (0.54) | GRIN2DGRIN2AGRIN2BGRIN2CHSD17B1 | |
| Biphenyl SCHEMBL13719514 | 0.90 | ALDH1A1 (0.45) | GRIN2DGRIN2AGRIN2BGRIN2CESR1 | |
| SCHEMBL13147477 | 0.89 | GRIN2D (0.44) | GRIN2DGRIN2AGRIN2BGRIN2CHSD17B1 | |
| Benzene SCHEMBL2725663 | 0.83 | ALDH1A1 (0.50) | ALDH1A1CYP1A2CYP2C19CYP3A4KDM4E | |
| SCHEMBL27616568 | 0.82 | ESR1 (0.57) | GRIN2DGRIN2AGRIN2BGRIN2CHSD17B1 | |
| SCHEMBL18422834 | 0.82 | ESR1 (0.50) | GRIN2DGRIN2AGRIN2BGRIN2CHSD17B1 | |
| SCHEMBL29527767 | 0.81 | POLB (0.52) | ALDH1A1MAPK1CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL132836 | 0.81 | POLB (0.52) | ALDH1A1MAPK1CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL27858229 | 0.81 | ESR1 (0.47) | HSD17B1HSD17B2ESR1ESR2ALDH1A1 | |
| SCHEMBL28543785 | 0.80 | ESR1 (0.44) | GRIN2DGRIN2AGRIN2BGRIN2CHSD17B1 |
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-2023132488-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2023-07-13 | — | — | WO | disclosed |