Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1463201 | 0.93 | ALDH1A1 (0.33) | — | |
| SCHEMBL17193578 | 0.82 | CA1 (0.32) | DGAT1CA12CA1CA14 | |
| SCHEMBL29121 | 0.77 | DGAT1 (0.46) | HDAC6HDAC1HDAC2ELANEDGAT1 | |
| SCHEMBL4924852 | 0.76 | ALDH1A1 (0.38) | HDAC6HDAC1HDAC2ELANEDGAT1 | |
| SCHEMBL1463203 | 0.76 | — | — | |
| SCHEMBL7207172 | 0.74 | LMNA (0.42) | ELANE | |
| Methyl Alcohol SCHEMBL28820308 | 0.74 | DGAT1 (0.43) | HDAC6HDAC1HDAC2ELANEDGAT1 | |
| Ammonia Solution, Strong SCHEMBL9998492 | 0.74 | DGAT1 (0.43) | HDAC6HDAC1HDAC2ELANEDGAT1 | |
| Fluoride SCHEMBL2692246 | 0.74 | DGAT1 (0.43) | HDAC6HDAC1HDAC2ELANEDGAT1 | |
| SCHEMBL28114416 | 0.74 | DGAT1 (0.43) | HDAC6HDAC1HDAC2ELANEDGAT1 |
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-111886230-A | Pyrrole derivatives as ACC inhibitors | 阿尔米雷尔有限公司 | 2020-11-03 | — | — | CN | disclosed |