Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | DBH | P09172 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27338904 | 1.00 | ELANE (0.33) | ELANEPGRADRA2AADRA2BHTR2A | |
| SCHEMBL17201709 | 0.83 | SPHK1 (0.32) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL27601754 | 0.83 | SLC7A5 (0.38) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL4316411 | 0.82 | KDM4E (0.47) | ELANEPGRADRA2AADRA2BHTR2A | |
| SCHEMBL27643168 | 0.80 | LMNA (0.34) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL27707450 | 0.79 | SLC7A5 (0.44) | ELANESLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28131090 | 0.78 | KMT2A (0.36) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL27749830 | 0.78 | HDAC3 (0.37) | PGRADRA2AADRA2BHTR2AHRH1 | |
| Dealkylated Diethylpropion SCHEMBL25176894 | 0.77 | TDP1 (0.52) | ELANEPGRADRA2AADRA2BHTR2A | |
| Cathinone SCHEMBL34513 | 0.77 | TDP1 (0.52) | ELANEPGRADRA2AADRA2BHTR2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101228124-A | Molecular modification of biological source compound and method for weeding | UNIV NANJING AGRICULTURAL (CN) | 2008-07-23 | — | — | CN | claimed |
| CN-1024011-C | Process for producing cephalosporin compound | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1994-03-16 | — | — | CN | disclosed |
| CN-87101581-A | Process for producing cephalosporin compound | — | 1987-09-30 | — | — | CN | disclosed |
| CN-85105977-A | The preparation method of antimicrobial compounds | — | 1987-02-25 | — | — | CN | disclosed |