Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.56 |
| ▸ | TTR | P02766 | 2/20 | 0.55 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.55 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.55 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.55 |
| ▸ | PGR | P06401 | 1/20 | 0.55 |
| ▸ | HTR1A | P08908 | 1/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.55 |
| ▸ | RARB | P10826 | 1/20 | 0.55 |
| ▸ | COMT | P21964 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.55 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL31406952 | 1.00 | GPR35 (0.56) | GPR35TTRABCC3ABCC4NR1I2 | |
| SCHEMBL27003698 | 0.87 | GPR35 (0.57) | GPR35TTRABCC3ABCC4NR1I2 | |
| SCHEMBL31406947 | 0.85 | ALDH1A1 (0.52) | GPR35TTRABCC3ABCC4NR1I2 | |
| SCHEMBL31406943 | 0.85 | ALDH1A1 (0.52) | GPR35TTRABCC3ABCC4NR1I2 | |
| SCHEMBL9438362 | 0.81 | ALDH1A1 (0.65) | ALDH1A1MAPTTDP1LMNAGAA | |
| SCHEMBL31406945 | 0.79 | ALDH1A1 (0.55) | GPR35TTRABCC3ABCC4NR1I2 | |
| SCHEMBL6770393 | 0.79 | MAOB (0.60) | GPR35PTGS2ALDH1A1MAPTLMNA | |
| SCHEMBL6770402 | 0.79 | MAOB (0.60) | GPR35PTGS2ALDH1A1MAPTLMNA | |
| SCHEMBL31406946 | 0.78 | GPR35 (0.57) | GPR35TTRABCC3ABCC4NR1I2 | |
| SCHEMBL31406955 | 0.78 | GPR35 (0.57) | GPR35TTRABCC3ABCC4NR1I2 |
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-119192005-A | Diamine monomer and preparation method thereof, polyimide material and preparation method and application thereof | 中国科学院长春应用化学研究所 | 2024-12-27 | — | — | CN | disclosed |