Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28162053 | 0.90 | TP53 (0.45) | TP53HTTALDH1A1KMT2AMEN1 | |
| SCHEMBL7321974 | 0.86 | PDE4A (0.61) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL11084913 | 0.81 | MEN1 (0.50) | ALDH1A1KMT2AMEN1KDM4EMAPT | |
| SCHEMBL7042336 | 0.79 | TP53 (0.56) | TP53HTTKMT2AACHEHIF1A | |
| SCHEMBL7389132 | 0.77 | PDE4A (0.49) | ALDH1A1KMT2AMEN1CYP1A2CYP2C19 | |
| SCHEMBL28162614 | 0.77 | PTPRA (0.40) | KMT2AMEN1CYP1A2CYP2C19KDM4E | |
| SCHEMBL6583680 | 0.76 | PDE4B (0.42) | TP53HTTALDH1A1KMT2AMEN1 | |
| SCHEMBL23610053 | 0.75 | ACHE (0.53) | TP53HTTKMT2AMEN1CYP1A2 | |
| SCHEMBL31143787 | 0.75 | ACHE (0.53) | TP53HTTKMT2AMEN1CYP1A2 | |
| SCHEMBL11619843 | 0.75 | ACHE (0.53) | TP53HTTKMT2AMEN1CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104837828-B | It is used as the phenylethyl pyridine derivate of PDE4 inhibitor | 奇斯药制品公司 | 2017-07-18 | — | — | CN | disclosed |
| CN-105814034-A | Benzhydryl derivatives for the treatment of respiratory diseases | 奇斯药制品公司 | 2016-07-27 | — | — | CN | disclosed |
| CN-105793250-A | Heteroaryl derivatives for the treatment of respiratory diseases | 奇斯药制品公司 | 2016-07-20 | — | — | CN | disclosed |