Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.41 |
| ▸ | BDKRB2 | P30411 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19350978 | 1.00 | LMNA (0.47) | LMNACYP1A2CYP2D6CYP2C19CSNK1E | |
| SCHEMBL18070687 | 0.84 | LMNA (0.46) | LMNACYP1A2CYP2D6CYP2C19KMT2A | |
| SCHEMBL22930088 | 0.84 | LMNA (0.46) | LMNACYP1A2CYP2D6CYP2C19SIGMAR1 | |
| SCHEMBL22930103 | 0.84 | LMNA (0.49) | LMNACYP1A2CYP2D6CYP2C19CSNK1E | |
| SCHEMBL22930105 | 0.84 | LMNA (0.49) | LMNACYP1A2CYP2D6CYP2C19CSNK1E | |
| SCHEMBL19350974 | 0.82 | LMNA (0.47) | LMNACYP1A2CYP2D6CYP2C19CSNK1E | |
| SCHEMBL9766502 | 0.82 | CSNK1E (0.41) | LMNACSNK1EBDKRB2KMT2AACE2 | |
| SCHEMBL9766510 | 0.82 | CSNK1E (0.41) | LMNACSNK1EBDKRB2KMT2AACE2 | |
| SCHEMBL20718669 | 0.82 | PSMD14 (0.46) | CSNK1EBDKRB2ACE2MAOAMAOB | |
| SCHEMBL8466447 | 0.82 | ESR1 (0.56) | LMNACSNK1E |
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-108976227-A | Benzothiazine -4- ketone compounds containing alkaline bridged ring segment and preparation method thereof | 浙江司太立制药股份有限公司 | 2018-12-11 | — | — | CN | claimed |
| CN-108976227-A | Benzothiazine -4- ketone compounds containing alkaline bridged ring segment and preparation method thereof | 浙江司太立制药股份有限公司 | 2018-12-11 | — | — | CN | disclosed |