Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPA1 | P15085 | 3/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL28180772 | 1.00 | CPA1 (0.47) | CPA1CNR1HTTKMT2AGAA | |
| SCHEMBL28606575 | 0.80 | MAPT (0.54) | CNR1HTTKMT2AGAANPSR1 | |
| SCHEMBL28606573 | 0.80 | MAPT (0.54) | CNR1HTTKMT2AGAANPSR1 | |
| SCHEMBL28180762 | 0.75 | MAPT (0.41) | CNR1HTTKMT2AGAANPSR1 | |
| SCHEMBL28609707 | 0.75 | MAPT (0.41) | CNR1HTTKMT2AGAANPSR1 | |
| SCHEMBL28180765 | 0.75 | MAPT (0.41) | CNR1HTTKMT2AGAANPSR1 | |
| SCHEMBL28619015 | 0.75 | MAPT (0.49) | CNR1HTTKMT2AGAANPSR1 | |
| SCHEMBL28619014 | 0.75 | MAPT (0.49) | CNR1HTTKMT2AGAANPSR1 | |
| SCHEMBL8646458 | 0.74 | CHRM1 (0.50) | HTTKMT2AGAANPSR1LMNA | |
| SCHEMBL28180769 | 0.73 | CNR1 (0.47) | CNR1HTTKMT2AGAANPSR1 |
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-107188771-A | Chiral synthesis method of gamma-nitrophenol compound | 浙江工业大学 | 2017-09-22 | — | — | CN | disclosed |