Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 6/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21868320 | 0.92 | AR (0.36) | ARALDH1A1HPGDKDM4EMAPT | |
| SCHEMBL29444845 | 0.86 | AR (0.35) | ARALDH1A1HPGDKDM4ETGFBR1 | |
| SCHEMBL28343597 | 0.85 | AR (0.38) | ARALDH1A1HPGDKDM4ENPC1 | |
| SCHEMBL20174714 | 0.83 | MAPK1 (0.32) | ARALDH1A1HPGDKDM4EMAPT | |
| SCHEMBL25766691 | 0.82 | KDM4E (0.39) | ARALDH1A1KDM4ENPC1TP53 | |
| SCHEMBL29518080 | 0.80 | PDK2 (0.35) | ARALDH1A1KDM4ENPC1MAPT | |
| SCHEMBL16381065 | 0.80 | PDK2 (0.35) | ARALDH1A1KDM4ENPC1MAPT | |
| SCHEMBL648192 | 0.80 | PDK2 (0.35) | ARALDH1A1KDM4ENPC1MAPT | |
| SCHEMBL24647376 | 0.80 | PTGS2 (0.33) | ARALDH1A1KDM4ETGFBR1NPC1 | |
| SCHEMBL21868024 | 0.79 | RAB9A (0.41) | ARALDH1A1HPGDKDM4ENPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230024114-A1 | ORGANIC LIGHT-EMITTING DEVICE | LG CHEM, LTD. (KR) | 2023-01-26 | — | — | US | disclosed |
| US-20220376178-A1 | ORGANIC LIGHT-EMITTING DEVICE | LG CHEM, LTD. (KR) | 2022-11-24 | — | — | US | disclosed |