Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDGFRB | P09619 | 1/20 | 0.51 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MC4R | P32245 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 2/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28005174 | 0.88 | ADORA1 (0.50) | ADORA1FYNALDH1A1MAPTKDM4E | |
| SCHEMBL28005161 | 0.82 | ADORA1 (0.43) | ADORA1FYNALDH1A1MAPTKDM4E | |
| SCHEMBL28005179 | 0.82 | ALDH1A1 (0.62) | ADORA1FYNALDH1A1MAPTKDM4E | |
| SCHEMBL28005177 | 0.81 | PDGFRB (0.50) | PDGFRBADORA1FYNALDH1A1MAPT | |
| SCHEMBL28005163 | 0.79 | FYN (0.59) | ADORA1FYNALDH1A1MAPTCYP1A2 | |
| SCHEMBL28005220 | 0.77 | TUBB4A (0.52) | ADORA1ALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL28005543 | 0.76 | ADORA1 (0.48) | ADORA1ALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL28005511 | 0.74 | ADORA1 (0.44) | TGFBR1ADORA1ALDH1A1MAPTKDM4E | |
| SCHEMBL28005506 | 0.73 | SMN1; SMN2 (0.53) | ADORA1ALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL28005576 | 0.73 | KDM4E (0.50) | ADORA1ALDH1A1MAPTKDM4EMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104418821-A | 2, 4-substituted 5- (3,4, 5-trimethoxyphenyl) thiazole derivative and preparation method and application thereof | WEST CHINA HOSPITAL SICHUAN UNIV | 2015-03-18 | — | — | CN | claimed |
| CN-104418821-A | 2, 4-substituted 5- (3,4, 5-trimethoxyphenyl) thiazole derivative and preparation method and application thereof | WEST CHINA HOSPITAL SICHUAN UNIV | 2015-03-18 | — | — | CN | disclosed |