Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SCN4A | P35499 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | RXRG | P48443 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17929073 | 0.91 | TSHR (0.39) | DRD2DRD4SCN4ATSHRKMT2A | |
| SCHEMBL183720 | 0.85 | LTA4H (0.40) | RIPK1L3MBTL1NPSR1TSHRALDH1A1 | |
| SCHEMBL13969481 | 0.78 | LTA4H (0.53) | RIPK1TSHRNPC1RAB9ALMNA | |
| Acetic Acid SCHEMBL28684431 | 0.77 | PPARG (0.42) | RIPK1L3MBTL1NPSR1KMT2AMEN1 | |
| SCHEMBL11780418 | 0.76 | DRD2 (0.41) | DRD2DRD4RIPK1SCN4ATSHR | |
| SCHEMBL15341309 | 0.75 | VDR (0.36) | KDM4E | |
| SCHEMBL133972 | 0.74 | TSHR (0.41) | TSHRKMT2AMEN1NPC1RAB9A | |
| SCHEMBL29690507 | 0.74 | TSHR (0.38) | DRD2DRD4RIPK1SCN4ATSHR | |
| SCHEMBL6825891 | 0.72 | SCN4A (0.39) | DRD2DRD4SCN4ATSHRKMT2A | |
| SCHEMBL9757873 | 0.72 | CA12 (0.43) | L3MBTL1ALDH1A1RXRARXRBRXRG |
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 |
|---|---|---|---|---|---|---|---|
| CN-116670108-A | Ether compounds as volatiles for treating amino acid based substrates such as skin and hair | 迈图高新材料有限责任公司 | 2023-08-29 | — | — | CN | claimed |