Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.35 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 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 | |
|---|---|---|---|---|
| SCHEMBL6126 | 0.80 | GABRP (0.46) | ESR2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL1203668 | 0.78 | ESR2 (0.35) | ESR2TRIM24TRIM33ALDH1A1GABRP | |
| SCHEMBL1148096 | 0.78 | SMN1; SMN2 (0.40) | ESR2ALDH1A1GABRPGABRDGABRA1 | |
| SCHEMBL3626745 | 0.78 | ESR2 (0.35) | ESR2TRIM24TRIM33ALDH1A1GABRP | |
| SCHEMBL667563 | 0.76 | ESR2 (0.39) | ESR2TRIM24TRIM33GABRPGABRD | |
| SCHEMBL1072394 | 0.75 | — | — | |
| SCHEMBL4941703 | 0.74 | ESR2 (0.37) | ESR2TRIM24TRIM33ALDH1A1 | |
| Ethylene SCHEMBL4702024 | 0.74 | LMNA (0.36) | ESR2 | |
| SCHEMBL10596838 | 0.74 | ESR2 (0.33) | ESR2 | |
| SCHEMBL76659 | 0.73 | — | — |
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-103804358-B | One class Diarylhydantoin derivant, its preparation method, pharmaceutical composition and application | 上海医药集团股份有限公司 | 2016-06-29 | — | — | CN | disclosed |