Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 4/20 | 0.75 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.75 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.75 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.75 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.75 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.75 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.75 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.75 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.75 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.75 |
| ▸ | LMNA | P02545 | 3/20 | 0.75 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.75 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.75 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.75 |
| ▸ | CGAS | Q8N884 | 2/20 | 0.75 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.75 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.75 |
| ▸ | APP | P05067 | 3/20 | 0.64 |
| ▸ | NQO2 | P16083 | 2/20 | 0.64 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL28644469 | 1.00 | ADRA1D (0.75) | ADRA1DCHRM2CHRM4CHRM5ADRA2A | |
| SCHEMBL709359 | 0.87 | CHRM2 (0.80) | ADRA1DCHRM2CHRM4CHRM5ADRA2A | |
| SCHEMBL19129074 | 0.87 | TMEM97 (0.80) | ADRA1DCHRM2CHRM4CHRM5ADRA2A | |
| Hydroxychloroquine SCHEMBL8623049 | 0.86 | CHRM2 (1.00) | ADRA1DCHRM2CHRM4CHRM5ADRA2A | |
| Hydroxychloroquine SCHEMBL31023589 | 0.86 | CHRM2 (1.00) | ADRA1DCHRM2CHRM4CHRM5ADRA2A | |
| Hydroxychloroquine SCHEMBL30107680 | 0.86 | CHRM2 (1.00) | ADRA1DCHRM2CHRM4CHRM5ADRA2A | |
| SCHEMBL1695848 | 0.86 | CHRM2 (0.78) | ADRA1DCHRM2CHRM4CHRM5ADRA2A | |
| Hydroxychloroquine SCHEMBL6746375 | 0.86 | CHRM2 (1.00) | ADRA1DCHRM2CHRM4CHRM5ADRA2A | |
| Hydroxychloroquine SCHEMBL8170 | 0.86 | CHRM2 (1.00) | ADRA1DCHRM2CHRM4CHRM5ADRA2A | |
| Hydroxychloroquine SCHEMBL9047 | 0.86 | CHRM2 (1.00) | ADRA1DCHRM2CHRM4CHRM5ADRA2A |
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-113440528-A | Application of optically pure 4-aminoquinoline compound in preparation of drugs for treating coronavirus | 上海华理生物医药股份有限公司 | 2021-09-28 | — | — | CN | disclosed |