Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | SOAT1 | P35610 | 11/20 | 0.48 |
| ▸ | S100A4 | P26447 | 1/20 | 0.48 |
| ▸ | ELANE | P08246 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.45 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10636128 | 0.81 | TSHR (0.55) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| Menadione SCHEMBL28771582 | 0.79 | ALDH1A1 (0.57) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| Anthraquinone SCHEMBL28110119 | 0.78 | ELANE (0.64) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| Anthraquinone SCHEMBL28110120 | 0.76 | ELANE (0.55) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| SCHEMBL10640730 | 0.76 | TSHR (0.50) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| SCHEMBL10639842 | 0.76 | TSHR (0.56) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| SCHEMBL31315022 | 0.76 | CDC25B (0.55) | TDP1L3MBTL1MAPK1CYP3A4TP53 | |
| SCHEMBL15514574 | 0.76 | CDC25B (0.55) | TDP1L3MBTL1MAPK1CYP3A4TP53 | |
| SCHEMBL9628020 | 0.75 | CDC25B (0.59) | ALDH1A1SOAT1S100A4 | |
| Anthraquinone SCHEMBL27653330 | 0.75 | ALDH1A1 (0.82) | TSHRTDP1L3MBTL1MAPK1CYP3A4 |
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-117466815-A | Synthesis method of azaanthrone compound | 西北工业大学 | 2024-01-30 | — | — | CN | claimed |