Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | ACHE | P22303 | 1/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.61 |
| ▸ | POLB | P06746 | 2/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | PGR | P06401 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | KCNA2 | P16389 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | MAOA | P21397 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL4269808 | 0.84 | ALDH1A1 (0.65) | ALDH1A1CYP1B1LMNAACHEKDM4E | |
| SCHEMBL20035921 | 0.81 | KDM4E (0.71) | ALDH1A1CYP1B1LMNAACHEKDM4E | |
| SCHEMBL9122678 | 0.80 | ALDH1A1 (0.71) | ALDH1A1CYP1B1LMNAACHEKDM4E | |
| SCHEMBL27293969 | 0.77 | KCNA3 (0.65) | ALDH1A1CYP1B1LMNAACHEKDM4E | |
| Isoimperatorin SCHEMBL15090959 | 0.77 | ALDH1A1 (1.00) | ALDH1A1CYP1B1LMNAACHEKDM4E | |
| Oxypeucedanin Hydrate SCHEMBL15944413 | 0.76 | KDM4E (1.00) | ALDH1A1CYP1B1LMNAACHEKDM4E | |
| Oxypeucedanin Hydrate SCHEMBL28952264 | 0.76 | KDM4E (1.00) | ALDH1A1CYP1B1LMNAACHEKDM4E | |
| SCHEMBL2799643 | 0.76 | KCNA3 (0.63) | ALDH1A1CYP1B1LMNAACHEKDM4E | |
| SCHEMBL30977122 | 0.76 | KDM4E (0.69) | ALDH1A1CYP1B1LMNAACHEKDM4E | |
| Oxypeucedanin Hydrate SCHEMBL29425179 | 0.76 | KDM4E (1.00) | ALDH1A1CYP1B1LMNAACHEKDM4E |
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-113456732-B | Composition for removing chloasma and preparation method thereof | 河北御芝林生物科技有限公司 | 2022-09-16 | — | — | CN | disclosed |