Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7311341 | 0.84 | POLB (0.44) | CYP3A4KDM4EHTTALDH1A1MAPK1 | |
| SCHEMBL14458097 | 0.78 | LMNA (0.52) | LMNACA12CA1CA2CA3 | |
| SCHEMBL27510132 | 0.72 | ALDH1A1 (0.45) | LMNAPTPN11CA12CA1CA2 | |
| SCHEMBL26162772 | 0.70 | CA12 (0.48) | LMNACA12CA1CA2CA5A | |
| SCHEMBL7316640 | 0.70 | KDM4E (0.40) | KDM4EALDH1A1MAPK1POLBGAA | |
| SCHEMBL22954292 | 0.70 | CYP1A2 (0.38) | KDM4EALDH1A1MAPK1NPSR1PTGS2 | |
| SCHEMBL10479256 | 0.69 | MAPK1 (0.47) | LMNACA12CA1CA2CA7 | |
| SCHEMBL1999533 | 0.69 | CA12 (0.56) | LMNACA12CA1CA2CA7 | |
| SCHEMBL16724446 | 0.69 | POLB (0.45) | KDM4EHTTALDH1A1MAPK1NPSR1 | |
| SCHEMBL26690020 | 0.68 | LMNA (0.43) | LMNACA12CA1CA2PKM |
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 |
|---|---|---|---|---|---|---|---|
| US-5891892-A | Small molecule biaryl compounds as inhibitors of endothelin converting enzyme | WARNER-LAMBERT COMPANY (US) | 1999-04-06 | — | — | US | disclosed |