Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 4/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA4 | P22748 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28612839 | 1.00 | POLB (0.39) | POLBCCR1S1PR5SIGMAR1S1PR1 | |
| SCHEMBL28624276 | 0.86 | LMNA (0.49) | SIGMAR1KMT2AALDH1A1FAAH | |
| SCHEMBL31599262 | 0.86 | POLB (0.38) | POLBCCR1S1PR5SIGMAR1S1PR1 | |
| SCHEMBL28577987 | 0.81 | LTA4H (0.40) | POLBCHRM4KMT2AALDH1A1HTT | |
| SCHEMBL28577985 | 0.81 | LTA4H (0.40) | POLBCHRM4KMT2AALDH1A1HTT | |
| SCHEMBL28610910 | 0.77 | GPR6 (0.35) | POLBS1PR5SIGMAR1S1PR1CHRM4 | |
| SCHEMBL28610908 | 0.77 | GPR6 (0.35) | POLBS1PR5SIGMAR1S1PR1CHRM4 | |
| SCHEMBL28622444 | 0.75 | KCNH2 (0.40) | KMT2AAGTR2FAAHKCNH2 | |
| SCHEMBL28612855 | 0.74 | SLC6A4 (0.31) | — | |
| SCHEMBL28612857 | 0.74 | SLC6A4 (0.31) | — |
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-113072546-A | Five-membered heteroaromatic derivative and preparation method and application thereof | 广东东阳光药业有限公司 | 2021-07-06 | — | — | CN | disclosed |