Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | DHODH | Q02127 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | SCN1A | P35498 | 2/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.39 |
| ▸ | CTSA | P10619 | 1/20 | 0.38 |
| ▸ | CDC7 | O00311 | 1/20 | 0.38 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.38 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Acetic Acid Butyl Ester SCHEMBL27443716 | 0.92 | ALDH1A1 (0.47) | ALDH1A1DHODHCNR2SCN1ASCN2A | |
| Acetic Acid Pentyl Ester SCHEMBL27892008 | 0.91 | CNR2 (0.47) | LMNAALDH1A1DHODHCNR2SCN1A | |
| Ethyl Acetate SCHEMBL27263183 | 0.89 | CDC7 (0.45) | LMNAALDH1A1DHODHSMN1; SMN2NPC1 | |
| Ethyl Acetate SCHEMBL27778289 | 0.87 | CDC7 (0.44) | LMNAALDH1A1DHODHSMN1; SMN2NPC1 | |
| Ethyl Acetate SCHEMBL27447758 | 0.87 | CDC7 (0.44) | LMNAALDH1A1DHODHSMN1; SMN2NPC1 | |
| Toluene SCHEMBL28297068 | 0.85 | CDC7 (0.45) | LMNAALDH1A1DHODHSMN1; SMN2NPC1 | |
| Acetic Acid SCHEMBL27690930 | 0.84 | DHODH (0.49) | LMNAALDH1A1DHODHSMN1; SMN2NPC1 | |
| E1501 SCHEMBL28758534 | 0.83 | ALDH1A1 (0.61) | LMNAALDH1A1DHODHSMN1; SMN2CYP2A6 | |
| Acetic Acid Methyl Ester SCHEMBL27352057 | 0.82 | DHODH (0.51) | LMNAALDH1A1DHODHSMN1; SMN2NPC1 | |
| Acetic Acid SCHEMBL27614844 | 0.82 | CYP2A6 (0.54) | LMNADHODHSMN1; SMN2NPC1CNR2 |
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-101735046-B | Treatment method of ethyl acetate industrial waste liquid | JIANGMEN HANDSOME CHEM DEV LTD | 2012-05-30 | — | — | CN | disclosed |
| CN-101735046-A | Method for processing industrial effluent of acetic ether | JIANGMEN HANDSOME CHEMICAL DEV | 2010-06-16 | — | — | CN | disclosed |