Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 11/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | HPGD | P15428 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | TLR7 | Q9NYK1 | 4/20 | 0.51 |
| ▸ | DCPS | Q96C86 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | NQO2 | P16083 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | DRD1 | P21728 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16836314 | 0.85 | TLR8 (0.79) | TLR8ALDH1A1HPGDKDM4EGAA | |
| SCHEMBL3343183 | 0.81 | KDM4E (0.69) | TLR8ALDH1A1HPGDKDM4EGAA | |
| Iodide SCHEMBL10800767 | 0.79 | KDM4E (0.67) | TLR8ALDH1A1HPGDKDM4EGAA | |
| SCHEMBL14533471 | 0.77 | KDM4E (0.53) | TLR8ALDH1A1HPGDKDM4EGAA | |
| SCHEMBL28002147 | 0.77 | KDM4E (0.53) | ALDH1A1HPGDKDM4EGAATDP1 | |
| Ammonia Solution, Strong SCHEMBL29175740 | 0.77 | GPR3 (0.53) | TLR8ALDH1A1HPGDKDM4EGAA | |
| SCHEMBL11703072 | 0.75 | KDM4E (0.51) | TLR8ALDH1A1HPGDKDM4EGAA | |
| SCHEMBL6263720 | 0.74 | TLR8 (0.82) | TLR8ALDH1A1HPGDKDM4EGAA | |
| SCHEMBL16836321 | 0.74 | TLR8 (0.74) | TLR8TLR7SMN1; SMN2 | |
| SCHEMBL16836317 | 0.74 | TLR8 (0.65) | TLR8ALDH1A1HPGDKDM4EGAA |
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-105829294-B | The quinolyl conditioning agent of ROR- γ-T being connect with methylene | 詹森药业有限公司 | 2018-11-09 | — | — | CN | disclosed |
| CN-105209453-B | The quinolyl conditioning agent of the methylene connection of ROR γ T | 詹森药业有限公司 | 2017-06-20 | — | — | CN | disclosed |