Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL25720295 | 0.79 | HSP90AA1 (0.38) | CYP1A2DRD2 | |
| SCHEMBL25720357 | 0.75 | ALDH1A1 (0.36) | TSHRALDH1A1ATMNPSR1NPC1 | |
| SCHEMBL4894905 | 0.75 | ALDH1A1 (0.46) | TSHRALDH1A1ATMNPSR1NPC1 | |
| SCHEMBL5357579 | 0.74 | ALDH1A1 (0.59) | TSHRALDH1A1ATMNPSR1NPC1 | |
| SCHEMBL23253870 | 0.74 | METAP1 (0.39) | ALDH1A1ATMNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL26778584 | 0.73 | TSHR (0.43) | TSHRALDH1A1ATMNPSR1NPC1 | |
| SCHEMBL25720243 | 0.73 | DRD2 (0.40) | L3MBTL1CYP1A2DRD2HTR2AHTR2C | |
| SCHEMBL29737067 | 0.71 | CYP1A2 (0.48) | TSHRALDH1A1ATMNPSR1NPC1 | |
| SCHEMBL6906334 | 0.71 | CYP1A2 (0.48) | TSHRALDH1A1ATMNPSR1NPC1 | |
| SCHEMBL31277051 | 0.69 | ALDH1A1 (0.64) | TSHRALDH1A1ATMNPSR1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4190779-A1 | HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT-EMITTING DEVICE | LT Materials Co., Ltd. (KR) | 2023-06-07 | — | — | EP | disclosed |